SCHEMBL7665986

SCHEMBL7665986

Brc1ccc(-c2ccc(OCc3ccccc3)cc2)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.60
LMNA P02545 1/20 0.60
CYP1A2 P05177 1/20 0.60
PTGS1 P23219 1/20 0.60
SLC6A2 P23975 1/20 0.60
CYP2C19 P33261 1/20 0.60
PTGS2 P35354 1/20 0.60
SLC6A3 Q01959 1/20 0.60
HIF1A Q16665 1/20 0.60
HDAC6 Q9UBN7 1/20 0.60
APP P05067 1/20 0.59
GSTP1 P09211 2/20 0.59
MAOB P27338 5/20 0.58
GAA P10253 1/20 0.58
MAPT P10636 1/20 0.58
MAOA P21397 1/20 0.58
RAB9A P51151 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
AR P10275 1/20 0.57

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
SCHEMBL8616107 1.00 MCL1 (0.60) MCL1LMNACYP1A2PTGS1SLC6A2
SCHEMBL228292 0.94 LMNA (0.67) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL4953 0.92 LMNA (0.64) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL197017 0.90 LMNA (0.72) MCL1LMNACYP1A2PTGS1SLC6A2
Methyl Alcohol SCHEMBL27428217 0.89 LMNA (0.66) LMNACYP1A2PTGS1SLC6A2CYP2C19
Formaldehyde SCHEMBL27728539 0.89 RXRA (0.62) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL12717358 0.89 LMNA (0.60) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL23483029 0.88 LMNA (0.69) MCL1LMNACYP1A2PTGS1SLC6A2
SCHEMBL1096817 0.88 LMNA (0.69) MCL1LMNACYP1A2PTGS1SLC6A2
SCHEMBL378828 0.87 GSTP1 (0.58) MCL1LMNACYP1A2PTGS1SLC6A2

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240083853-A1 HSD17B13 INHIBITORS AND USES THEREOF FL2022-001, INC. 2024-03-14 US disclosed
CN-116600801-A HSD17B13 inhibitors and uses thereof FL2022-001公司 2023-08-15 CN disclosed
EP-4221701-A1 HSD17B13 INHIBITORS AND USES THEREOF FL2022-001, Inc. (US) 2023-08-09 EP disclosed
WO-2022072491-A1 HSD17B13 INHIBITORS AND USES THEREOF METACRINE, INC. (US) 2022-04-07 WO disclosed
US-20180142152-A1 COMPOUNDS FOR THE HOMEOTROPIC ALIGNMENT OF LIQUID-CRYSTALLINE MEDIA MERCK PATENT GMBH (DE) 2018-05-24 US disclosed
US-9761804-B2 Oligomeric organic light emitting diode (OLED) materials containing multiple crosslinking functions LOMOX LIMITED (GB) 2017-09-12 US disclosed
US-9761804-B2 Oligomeric organic light emitting diode (OLED) materials containing multiple crosslinking functions LOMOX LIMITED (GB) 2017-09-12 US disclosed
EP-2697232-B1 6,7-DIHYDROIMIDAZO[2,1-B][1,3]OXAZINE BACTERICIDES OTSUKA PHARMA CO LTD (JP) 2016-05-18 EP disclosed
US-9051333-B2 6,7-dihydroimidazo [2,1-b] [1,3]oxazine bactericides OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2015-06-09 US disclosed
US-20140031342-A1 6,7-DIHYDROIMIDAZO [2,1-b] [1,3]OXAZINE BACTERICIDES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2014-01-30 US disclosed
US-20110118429-A1 CHARGE TRANSPORT MATERIALS E.I. DU PONT DE NEMOURS AND COMPANY (US) 2011-05-19 US disclosed
US-6388146-B1 AROMATIC UNSATURATED NOMONER SHARP KABUSHIKI KAISHA (JP) 2002-05-14 US disclosed
US-5814378-A ACRYLATED ESTER OF A BIPHENYL COMPOUND SHARP KABUSHIKI KAISHA (JP) 1998-09-29 US 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 (3 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-20240083853-A1 HSD17B13 INHIBITORS AND USES THEREOF HSD17B3, HSD17B11, HSD17B1 MCL1 4011/4885LMNA 1218/4885CYP1A2 146/4885
US-20140031342-A1 6,7-DIHYDROIMIDAZO [2,1-b] [1,3]OXAZINE BACTERICIDES BRD1, OXA1L, QDPR MCL1 3073/4885LMNA 4252/4885CYP1A2 594/4885
US-20110118429-A1 CHARGE TRANSPORT MATERIALS SLC6A19, SLC6A15, SLC43A3 MCL1 4707/4885LMNA 1190/4885CYP1A2 4577/4885

“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.