SCHEMBL9925889

SCHEMBL9925889

Bc1ccc(-c2ccc(C)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 5/20 0.50
TDP1 Q9NUW8 1/20 0.50
HPGD P15428 2/20 0.39
NOTUM Q6P988 2/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
POLB P06746 1/20 0.39
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ALDH1A1 P00352 2/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
ENPP3 O14638 1/20 0.38
ENPP1 P22413 1/20 0.38
KIF11 P52732 1/20 0.38
KDM4E B2RXH2 1/20 0.38

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
SCHEMBL170471 0.90
Water SCHEMBL27491352 0.87 ACHE (0.57) ACHETDP1ALDH1A1CA1CA2
Fluoride SCHEMBL28004863 0.87
SCHEMBL26552898 0.85 CYP1A2 (0.46) ACHETDP1HPGDNPC1RAB9A
SCHEMBL3568731 0.85 ALDH1A1 (0.42) ACHETDP1HPGDNOTUMNPC1
SCHEMBL10055045 0.85 ALDH1A1 (0.42) ACHETDP1HPGDNOTUMNPC1
SCHEMBL13071798 0.83 MEN1 (0.49) ACHETDP1HPGDNPC1RAB9A
SCHEMBL197731 0.83 ACHE (0.73) ACHETDP1HPGDALDH1A1CA1
SCHEMBL18661495 0.83 ACHE (0.73) ACHETDP1HPGDALDH1A1CA1
SCHEMBL21442484 0.83 ALDH1A1 (0.38) TDP1ALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023070987-A9 ORGANIC COMPOUND, ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME, AND ELECTRONIC APPARATUS 陕西莱特光电材料股份有限公司 2023-08-24 WO disclosed
US-20230217813-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE DEVICE, ORGANIC ELECTROLUMINESCENCE DEVICE, AND ELECTRONIC APPARATUS IDEMITSU KOSAN CO.,LTD. (JP) 2023-07-06 US disclosed
WO-2023087557-A1 ORGANIC ELECTROLUMINESCENT DEVICE AND ELECTRONIC DEVICE 陕西莱特光电材料股份有限公司 2023-05-25 WO disclosed
WO-2023070987-A1 ORGANIC COMPOUND, ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME, AND ELECTRONIC APPARATUS 陕西莱特光电材料股份有限公司 2023-05-04 WO disclosed
CN-115785313-A Polypropylene and preparation method thereof LG化学株式会社 2023-03-14 CN disclosed
CN-110099934-B Polypropylene and preparation method thereof LG化学株式会社 2023-01-31 CN disclosed
CN-111683977-B Polypropylene resin pellet and preparation method thereof LG化学株式会社 2022-12-27 CN disclosed
EP-3697788-B1 BIS(PENTAHYDROXYHEXYL)AMINO SUBSTITUTED 2-{[(3-AMINO-PYRAZIN-2-YL)FORMAMIDO]METHYL}-1H-1,3-BENZODIAZOL-3-IUM DERIVATIVES AS ENAC INHIBITORS FOR TREATING RESPIRATORY DISEASES ENTERPRISE THERAPEUTICS LTD (GB) 2021-12-15 EP disclosed
CN-109563323-B Polypropylene-based resin composition LG化学株式会社 2021-12-03 CN disclosed
CN-113039190-A Transition metal compound and catalyst composition comprising the same LG化学株式会社 2021-06-25 CN disclosed
WO-2019156439-A1 COMPOUNDS FOR INHIBITING TNIK AND MEDICAL USES THEREOF KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2019-08-15 WO disclosed
US-9644065-B2 PHT powder coating materials INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2017-05-09 US disclosed
US-20160108164-A1 PHT POWDER COATING MATERIALS INTERNATIONAL BUSINESS MACHINES CORPORATION 2016-04-21 US disclosed
EP-1618087-B1 ANTIBACTERIAL AGENTS NOVARTIS VACCINES & DIAGNOSTIC (US) 2012-06-13 EP disclosed
US-8022033-B2 Echinocandin/carbohydrate complexes ELI LILLY AND COMPANY (US) 2011-09-20 US disclosed
US-20090258820-A1 ECHINOCANDIN/CARBOHYDRATE COMPLEXES ELI LILLY AND COMPANY 2009-10-15 US disclosed
WO-2008120957-A1 LIGHT-EMITTING COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING THE SAME JINWOONG INDUSTRIAL CO., LTD. (KR) 2008-10-09 WO disclosed
EP-1903036-A1 Reactive mesogenic charge transport compounds containing at least two thiophene groups Merck Patent GmbH (DE) 2008-03-26 EP disclosed
EP-1626976-B1 OLEFIN POLYMERIZATION CATALYST SYSTEM EXXONMOBIL CHEM PATENTS INC (US) 2007-10-17 EP disclosed
EP-1626999-B1 OLEFIN POLYMERIZATION CATALYST SYSTEM USEFUL FOR POLAR MONOMERS EXXONMOBIL CHEM PATENTS INC (US) 2007-09-26 EP 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 (2 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-20090258820-A1 ECHINOCANDIN/CARBOHYDRATE COMPLEXES ERG28, TREH, MAN2A1 ACHE 4381/4885TDP1 4645/4885HPGD 1485/4885
US-20230217813-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE DEVICE, ORGANIC ELECTROLUMINESCENCE DEVICE, AND ELECTRONIC APPARATUS L1CAM, LEF1, PIEZO1 ACHE 1192/4885TDP1 3589/4885HPGD 4406/4885

“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.