SCHEMBL6348334

SCHEMBL6348334

Oc1cc2cccc(Cl)c2cc1O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DAO P14920 2/20 0.52
CYP1A2 P05177 3/20 0.50
CYP2A6 P11509 2/20 0.50
HSD17B1 P14061 2/20 0.47
HSD17B2 P37059 2/20 0.47
TRPM4 Q8TD43 1/20 0.46
TSHR P16473 1/20 0.44
ALDH1A1 P00352 2/20 0.42
KDM4E B2RXH2 1/20 0.42
GLA P06280 1/20 0.42
GRIN2D O15399 1/20 0.41
GRIN2A Q12879 1/20 0.41
GRIN2B Q13224 1/20 0.41
GRIN2C Q14957 1/20 0.41
PLAU P00749 1/20 0.41
NQO2 P16083 1/20 0.40
IGFBP3 P17936 2/20 0.40
ESR1 P03372 1/20 0.38
ESR2 Q92731 1/20 0.38
ALOX5 P09917 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
SCHEMBL22743919 0.84 HSD17B1 (0.46) DAOCYP1A2CYP2A6HSD17B1HSD17B2
SCHEMBL5668937 0.83 CYP2A6 (0.62) DAOCYP1A2CYP2A6HSD17B1HSD17B2
SCHEMBL29972350 0.83 CYP2A6 (0.62) DAOCYP1A2CYP2A6HSD17B1HSD17B2
SCHEMBL25363995 0.81 DAO (0.44) DAOCYP1A2CYP2A6HSD17B1HSD17B2
SCHEMBL25361609 0.81 CYP1A2 (0.41) DAOCYP1A2CYP2A6HSD17B1HSD17B2
SCHEMBL6322817 0.80 CYP1A2 (0.59) DAOCYP1A2CYP2A6HSD17B1HSD17B2
SCHEMBL29707166 0.80 CYP1A2 (0.59) DAOCYP1A2CYP2A6HSD17B1HSD17B2
SCHEMBL22721607 0.79 GRIN2D (0.62) TSHRALDH1A1KDM4EGRIN2DGRIN2A
SCHEMBL30641717 0.78 CYP2A6 (0.56) DAOCYP1A2CYP2A6HSD17B1HSD17B2
SCHEMBL7793914 0.78 GRIN2D (0.61) CYP1A2HSD17B1HSD17B2TRPM4TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6878659-B2 Solid catalyst component for olefin polymerization and catalyst TOHO TITANIUM CO., LTD. (JP) 2005-04-12 US disclosed
US-20040072681-A1 Solid catalyst component for olefin polymerization and catalyst TOHO TITANIUM CO., LTD. (JP) 2004-04-15 US disclosed
EP-1260524-A1 SOLID CATALYST COMPONENT FOR OLEFIN POLYMERIZATION AND CATALYST Toho Titanium Co., Ltd. (JP) 2002-11-27 EP disclosed