SCHEMBL7651339

SCHEMBL7651339

CC1=Cc2ccccc2C1c1cccc2ccc3ccccc3c12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 6/20 0.39
HPGD P15428 5/20 0.39
TSHR P16473 5/20 0.39
CYP3A4 P08684 3/20 0.39
L3MBTL1 Q9Y468 3/20 0.39
RAB9A P51151 2/20 0.39
MAPK1 P28482 1/20 0.39
CASP1 P29466 1/20 0.39
CASP7 P55210 1/20 0.39
ATM Q13315 1/20 0.39
HIF1A Q16665 1/20 0.39
ALDH1A1 P00352 6/20 0.37
CYP1A2 P05177 4/20 0.37
THRB P10828 1/20 0.37
KDM1A O60341 1/20 0.37
CYP2A6 P11509 3/20 0.36
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
RCE1 Q9Y256 1/20 0.34
TDP1 Q9NUW8 2/20 0.33

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
Hydrochloric Acid SCHEMBL7937366 0.97 HSD17B10 (0.37) HSD17B10HPGDTSHRCYP3A4L3MBTL1
SCHEMBL5477612 0.87 KDM1A (0.44) HSD17B10HPGDTSHRCYP3A4ALDH1A1
SCHEMBL3214317 0.80 MYB (0.40) HSD17B10HPGDCYP3A4MAPK1ALDH1A1
SCHEMBL3201778 0.77 MEN1 (0.33) HSD17B10ATMALDH1A1KDM1ACYP2A6
SCHEMBL3209431 0.77 EPHX1 (0.35) CYP3A4L3MBTL1RAB9AALDH1A1CYP1A2
SCHEMBL3207496 0.77 MAPT (0.36) HSD17B10HPGDTSHRL3MBTL1RAB9A
SCHEMBL3208877 0.77 KMT2A (0.49) HPGDL3MBTL1ALDH1A1THRBMEN1
SCHEMBL3207501 0.77 MAPT (0.36) HSD17B10HPGDTSHRL3MBTL1RAB9A
SCHEMBL3208869 0.77 KMT2A (0.49) HPGDL3MBTL1ALDH1A1THRBMEN1
SCHEMBL7034020 0.76 ALDH1A1 (0.37) HSD17B10HPGDHIF1AALDH1A1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2002038637-A1 METHOD FOR COPOLYMERIZING PROPENE AND/OR ETHENE WITH 1-OLEFINS ON METALLOCENE CARRIER CATALYSTS BASELL POLYPROPYLEN GMBH (DE) 2002-05-16 WO disclosed