SCHEMBL75606

SCHEMBL75606

O=C1C(c2ccccc2)=C2C(=C1c1ccccc1)c1cccc3cccc2c13

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.56
CES2 O00748 1/20 0.56
BCHE P06276 1/20 0.56
CES1 P23141 1/20 0.56
MCL1 Q07820 1/20 0.56
CASP1 P29466 2/20 0.53
CASP7 P55210 2/20 0.53
PABPC1 P11940 2/20 0.53
DNMT1 P26358 2/20 0.53
CYP3A4 P08684 1/20 0.53
TSHR P16473 2/20 0.48
MAPK1 P28482 2/20 0.48
HSD17B10 Q99714 2/20 0.48
ATM Q13315 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
TYMS P04818 2/20 0.47
PARP1 P09874 1/20 0.45
P2RX7 Q99572 1/20 0.44
HPGD P15428 2/20 0.43
TP53 P04637 1/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29773784 1.00 ALDH1A1 (0.56) ALDH1A1CES2BCHECES1MCL1
SCHEMBL18845637 0.89 ALDH1A1 (0.48) ALDH1A1CES2BCHECES1MCL1
SCHEMBL4590261 0.85 ALDH1A1 (0.59) ALDH1A1CES2BCHECES1MCL1
SCHEMBL728673 0.83 ALDH1A1 (0.50) ALDH1A1CES2BCHECES1MCL1
SCHEMBL12683614 0.83 ESR1 (0.40) ALDH1A1CES2BCHECES1MCL1
SCHEMBL14680387 0.83 PTPN1 (0.41) ALDH1A1CES2BCHECES1MCL1
SCHEMBL10304455 0.81 ALDH1A1 (0.54) ALDH1A1CES2BCHECES1MCL1
SCHEMBL10048166 0.81 ESR1 (0.39) ALDH1A1CES2BCHECES1MCL1
Acenaphthoquinone SCHEMBL19212172 0.81 ALDH1A1 (0.77) ALDH1A1CES2BCHECES1MCL1
SCHEMBL22143430 0.81 FGFR1 (0.55) ALDH1A1CES2BCHECES1MAPK1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 180 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113603716-B Polycyclic aromatic hydrocarbon silane coupling agent with strong fluorescence characteristic and green efficient preparation and application thereof 山东硅科新材料有限公司 2024-03-19 CN claimed
CN-113603716-B Polycyclic aromatic hydrocarbon silane coupling agent with strong fluorescence characteristic and green efficient preparation and application thereof 山东硅科新材料有限公司 2024-03-19 CN disclosed
EP-3151919-B1 CARBON MONOXIDE-RELEASING MOLECULES FOR THERAPEUTIC APPLICATIONS AND METHODS OF MAKING AND USING THEREOF UNIV GEORGIA STATE RES FOUND (US) 2023-08-30 EP disclosed
WO-2023112672-A1 SEMICONDUCTOR SUBSTRATE PRODUCTION METHOD AND COMPOSITION JSR株式会社 2023-06-22 WO disclosed
US-11370733-B2 Organic compound, organic light-emitting element, display device, imaging device, electronic device, illumination device, and moving object CANON KABUSHIKI KAISHA (JP) 2022-06-28 US disclosed
US-11196007-B2 Organic compound, organic light-emitting element, display apparatus, image pickup apparatus, electronic device, and moving object CANON KABUSHIKI KAISHA (JP) 2021-12-07 US disclosed
US-11196006-B2 Organic compound and organic light-emitting element CANON KABUSHIKI KAISHA (JP) 2021-12-07 US disclosed
US-20210221835-A1 CARBON-MONOXIDE-RELEASING MOLECULES AND THERAPEUTIC APPLICATIONS THEREOF GEORGIA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2021-07-22 US disclosed
US-10751344-B2 Carbon monoxide-releasing molecules for therapeutic applications and methods for the preparation and use thereof GEORGIA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2020-08-25 US disclosed
US-10680182-B2 Fluoranthene compound, and organic electronic device comprising same LG CHEM, LTD. (KR) 2020-06-09 US disclosed
US-20080074045-A1 ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2008-03-27 US disclosed
US-20080074045-A1 ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2008-03-27 US disclosed
US-20080071122-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND MATERIAL FOR ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2008-03-20 US disclosed
US-20080071122-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND MATERIAL FOR ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2008-03-20 US disclosed
WO-2007114038-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING THE COMPOUND CANON KABUSHIKI KAISHA (JP) 2007-10-11 WO disclosed
US-20070069198-A1 Synthesis of phenyl-substituted fluoranthenes by a diesel-alder reaction and the use thereof BASF AKTIENGESSLLSCHAFT (DE) 2007-03-29 US disclosed
US-20070003788-A1 Organic electroluminescence device IDEMITSU KOSAN CO., LTD. (JP) 2007-01-04 US disclosed
US-20070003788-A1 Organic electroluminescence device IDEMITSU KOSAN CO., LTD. (JP) 2007-01-04 US disclosed
EP-1673322-A1 SYNTHESIS OF PHENYL-SUBSTITUTED FLUORANTHENES BY A DIESEL-ALDER REACTION AND THE USE THEREOF BASF Aktiengesellschaft (DE) 2006-06-28 EP disclosed
WO-2005033051-A1 SYNTHESIS OF PHENYL-SUBSTITUTED FLUORANTHENES BY A DIESEL-ALDER REACTION AND THE USE THEREOF BASF AKTIENGESELLSCHAFT (DE) 2005-04-14 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11196007-B2 Organic compound, organic light-emitting element, display apparatus, image pickup apparatus, electronic device, and moving object OCIAD1, OCIAD2, OR51E2 ALDH1A1 319/4885CES2 2048/4885BCHE 2860/4885
US-20070069198-A1 Synthesis of phenyl-substituted fluoranthenes by a diesel-alder reaction and the use thereof OXER1, DRD3, DRD4 ALDH1A1 393/4885CES2 621/4885BCHE 2537/4885
US-11196006-B2 Organic compound and organic light-emitting element CRY1, CRY2, NR2E3 ALDH1A1 52/4885CES2 1946/4885BCHE 4284/4885
US-20210221835-A1 CARBON-MONOXIDE-RELEASING MOLECULES AND THERAPEUTIC APPLICATIONS THEREOF MB, HMOX1, CYC1 ALDH1A1 711/4885CES2 258/4885BCHE 241/4885
US-10751344-B2 Carbon monoxide-releasing molecules for therapeutic applications and methods for the preparation and use thereof MB, CYC1, HMOX1 ALDH1A1 889/4885CES2 225/4885BCHE 204/4885
US-10680182-B2 Fluoranthene compound, and organic electronic device comprising same AFF2, ESR1, AFF4 ALDH1A1 1216/4885CES2 1219/4885BCHE 1745/4885
US-11370733-B2 Organic compound, organic light-emitting element, display device, imaging device, electronic device, illumination device, and moving object OCIAD1, L1CAM, SPIN4 ALDH1A1 283/4885CES2 1307/4885BCHE 4209/4885
US-20080071122-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND MATERIAL FOR ORGANIC ELECTROLUMINESCENCE DEVICE LEF1, EFNA1, L1CAM ALDH1A1 318/4885CES2 553/4885BCHE 2124/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.