SCHEMBL901849

SCHEMBL901849

Brc1cc2ccccc2c(Br)n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.42
HSD17B10 Q99714 4/20 0.42
HIF1A Q16665 2/20 0.42
CYP1B1 Q16678 1/20 0.42
CYP11B1 P15538 1/20 0.41
HPGD P15428 3/20 0.40
KDM4E B2RXH2 3/20 0.40
CYP1A2 P05177 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
GLA P06280 1/20 0.40
CYP2C19 P33261 1/20 0.40
L3MBTL1 Q9Y468 3/20 0.39
MAPK1 P28482 2/20 0.39
TSHR P16473 2/20 0.39
CASP1 P29466 1/20 0.39
TDP1 Q9NUW8 3/20 0.38
MAPT P10636 2/20 0.38
TRPM4 Q8TD43 1/20 0.38
CYP2A6 P11509 3/20 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
SCHEMBL30133425 1.00 ALDH1A1 (0.42) ALDH1A1HSD17B10HIF1ACYP1B1CYP11B1
SCHEMBL29751038 1.00 ALDH1A1 (0.42) ALDH1A1HSD17B10HIF1ACYP1B1CYP11B1
SCHEMBL28216191 0.87 PLAU (0.44) ALDH1A1HSD17B10HIF1ACYP1B1CYP11B1
SCHEMBL30064841 0.77 KDM4E (0.44) ALDH1A1HSD17B10HIF1ACYP1B1HPGD
SCHEMBL374938 0.77 ALDH1A1 (0.39) ALDH1A1HSD17B10HIF1ACYP1B1CYP11B1
SCHEMBL305348 0.77 CYP1A2 (0.40) ALDH1A1HSD17B10HIF1ACYP1B1HPGD
SCHEMBL2519509 0.77 CYP2A6 (0.47) ALDH1A1HSD17B10HIF1ACYP1B1CYP11B1
SCHEMBL303815 0.77 KDM4E (0.44) ALDH1A1HSD17B10HIF1ACYP1B1HPGD
SCHEMBL31165772 0.77 CYP1A2 (0.45) ALDH1A1HSD17B10HIF1ACYP1B1HPGD
SCHEMBL4741365 0.77 CYP1A2 (0.45) ALDH1A1HSD17B10HIF1ACYP1B1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105384767-A S,S-dioxo-dibenzothiophene onium salt based polymer precursor monomer and polymer, and preparation method therefor and application thereof UNIV SOUTH CHINA TECH 2016-03-09 CN claimed
US-12570671-B2 Substituted oxoisoindoline compounds for the treatment of cancer BRISTOL-MYERS SQUIBB COMPANY (US) 2026-03-10 US disclosed
EP-4126843-B1 SUBSTITUTED OXOISOINDOLINE COMPOUNDS FOR THE TREATMENT OF CANCER BRISTOL MYERS SQUIBB CO (US) 2026-02-11 EP disclosed
US-20240300951-A1 Pyrazolopyridinone Compounds BEIGENE LTD. (KY) 2024-09-12 US disclosed
US-20240270751-A1 Pyrazolopyridinone Compounds BEIGENE LTD. (KY) 2024-08-15 US disclosed
CN-117836296-A Pyrazolopyridone compounds 百济神州有限公司 2024-04-05 CN disclosed
US-20230322803-A1 SUBSTITUTED OXOISOINDOLINE COMPOUNDS FOR THE TREATMENT OF CANCER BRISTOL MYERS SQUIBB CO (US) 2023-10-12 US disclosed
WO-2023185986-A1 BCL-XL INHIBITORS BEIGENE , LTD. (KY) 2023-10-05 WO disclosed
EP-4126843-A1 SUBSTITUTED OXOISOINDOLINE COMPOUNDS FOR THE TREATMENT OF CANCER Bristol-Myers Squibb Company (US) 2023-02-08 EP disclosed
CN-115605466-A Substituted oxoisoindoline compounds for the treatment of cancer 百时美施贵宝公司(US) 2023-01-13 CN disclosed
US-6875761-B2 Certain 1,3-disubstituted isoquinoline derivatives EISAI CO., LTD. (JP) 2005-04-05 US disclosed
US-20040204421-A1 Certain 1,3-disubstituted isoquinoline derivatives EISAI CO., LTD. 2004-10-14 US disclosed
US-6790844-B2 MUSCLE RELAXANTS; ANTISEROTONINE AGENT EISAI CO., LTD (JP) 2004-09-14 US disclosed
US-20040092740-A1 Substituted pyridines and pyridazines with angiogenesis inhibiting activity BAYER PHARMACEUTICALS CORPORATION 2004-05-13 US disclosed
US-6689883-B1 Substituted pyridines and pyridazines with angiogenesis inhibiting activity BAYER PHARMACEUTICALS CORPORATION 2004-02-10 US disclosed
EP-1228063-A2 SUBSTITUTED PYRIDINES AND PYRIDAZINES WITH ANGIOGENESIS INHIBITING ACTIVITY Bayer Corporation (US) 2002-08-07 EP disclosed
US-20020013460-A1 Condensed pyridine compound EISAI CO., LTD 2002-01-31 US disclosed
US-6340759-B1 ANTISPASMODIC AGENTS EISAI CO., LTD. (JP) 2002-01-22 US disclosed
WO-2001023375-A2 SUBSTITUTED PYRIDINES AND PYRIDAZINES WITH ANGIOGENESIS INHIBITING ACTIVITY BAYER CORPORATION (US) 2001-04-05 WO disclosed
EP-1020445-A1 FUSED PYRIDINE DERIVATIVES Eisai Co., Ltd. (JP) 2000-07-19 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 (7 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-20040092740-A1 Substituted pyridines and pyridazines with angiogenesis inhibiting activity VEGFA, PGF, FLT1 ALDH1A1 725/4885HSD17B10 2706/4885HIF1A 140/4885
US-20020013460-A1 Condensed pyridine compound MUSK, HTR1A, PAX3 ALDH1A1 2989/4885HSD17B10 3854/4885HIF1A 2778/4885
US-20230322803-A1 SUBSTITUTED OXOISOINDOLINE COMPOUNDS FOR THE TREATMENT OF CANCER DDX21, HRAS, RPL17 ALDH1A1 1946/4885HSD17B10 1771/4885HIF1A 1038/4885
US-20240300951-A1 Pyrazolopyridinone Compounds NFATC1, CD4, PBK ALDH1A1 1296/4885HSD17B10 3662/4885HIF1A 3188/4885
US-12570671-B2 Substituted oxoisoindoline compounds for the treatment of cancer NR3C1, NR2C2, RIOX2 ALDH1A1 3404/4885HSD17B10 2828/4885HIF1A 1577/4885
US-20240270751-A1 Pyrazolopyridinone Compounds NFATC1, CD4, PBK ALDH1A1 1296/4885HSD17B10 3662/4885HIF1A 3188/4885
US-20040204421-A1 Certain 1,3-disubstituted isoquinoline derivatives MUSK, HTR1A, RYR1 ALDH1A1 1071/4885HSD17B10 3472/4885HIF1A 1640/4885

“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.