SCHEMBL30640484

SCHEMBL30640484

Cc1ccc2ccc(C)c(Br)c2c1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 7/20 0.54
CYP2A6 P11509 5/20 0.54
ALDH1A1 P00352 6/20 0.45
HSD17B10 Q99714 3/20 0.45
KDM4E B2RXH2 2/20 0.45
LMNA P02545 2/20 0.45
HPGD P15428 2/20 0.45
GAA P10253 1/20 0.45
TDP1 Q9NUW8 3/20 0.39
TSHR P16473 1/20 0.37
MAOA P21397 1/20 0.36
TP53 P04637 1/20 0.34
MAPK1 P28482 1/20 0.34
MAPT P10636 1/20 0.34
ALOX15 P16050 1/20 0.34

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
SCHEMBL3267082 1.00 CYP1A2 (0.54) CYP1A2CYP2A6ALDH1A1HSD17B10KDM4E
SCHEMBL3274182 0.84 ALDH1A1 (0.59) CYP1A2CYP2A6ALDH1A1HSD17B10KDM4E
SCHEMBL6041439 0.82 TYMS (0.41) CYP1A2CYP2A6ALDH1A1KDM4ELMNA
SCHEMBL32664327 0.81 CYP1A2 (0.50) CYP1A2CYP2A6ALDH1A1HSD17B10KDM4E
SCHEMBL3267833 0.78 CYP3A4 (0.43) CYP1A2CYP2A6ALDH1A1LMNAHPGD
SCHEMBL28795619 0.78 POLB (0.55) CYP1A2CYP2A6ALDH1A1HSD17B10LMNA
SCHEMBL3268719 0.78 TYMS (0.39) CYP1A2CYP2A6ALDH1A1TSHRMAPT
SCHEMBL30694959 0.77 CYP1A2 (0.65) CYP1A2CYP2A6ALDH1A1HSD17B10KDM4E
SCHEMBL599276 0.77 CYP1A2 (0.65) CYP1A2CYP2A6ALDH1A1HSD17B10KDM4E
SCHEMBL30518173 0.76 CYP1A2 (0.58) CYP1A2CYP2A6ALDH1A1HSD17B10KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119039233-A Pyridazinone herbicides and pyridazinone intermediates for preparing the same FMC公司 2024-11-29 CN disclosed
CN-118994028-A Pyridazinone herbicides and pyridazinone intermediates for preparing the same FMC公司 2024-11-22 CN disclosed
CN-113166075-B Pyridazinone herbicides and pyridazinone intermediates for preparing the same FMC公司 2024-10-25 CN disclosed
WO-2023214325-A1 PYRAZOLOPYRIMIDINE DERIVATIVES AND USES THEREOF AS TET2 INHIBITORS NOVARTIS AG (CH) 2023-11-09 WO disclosed