SCHEMBL6949064

SCHEMBL6949064

C=CCc1cc(C2(c3cc(C)c(O)c(CC=C)c3)c3ccccc3-c3ccccc32)cc(C)c1O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.51
ESR2 Q92731 1/20 0.51
ALOX5 P09917 2/20 0.43
PTGS1 P23219 1/20 0.43
PTGS2 P35354 1/20 0.43
GABRA1 P14867 3/20 0.43
GABRB2 P47870 3/20 0.43
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
AKR1B1 P15121 1/20 0.38
GAA P10253 3/20 0.38
LMNA P02545 3/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
MAPT P10636 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
POLB P06746 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
ALDH1A1 P00352 1/20 0.36
KDM4E B2RXH2 3/20 0.34
OPRK1 P41145 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
SCHEMBL15815775 0.90 GABRA1 (0.49) ESR1ESR2ALOX5PTGS1PTGS2
SCHEMBL4827264 0.85 GABRA1 (0.44) ESR1ESR2GABRA1GABRB2MEN1
SCHEMBL18382528 0.84 ESR1 (0.58) ESR1ESR2GABRA1GABRB2MEN1
SCHEMBL20233960 0.84 DHFR (0.41) ESR1ESR2ALOX5PTGS1PTGS2
SCHEMBL7723158 0.84 GABRA1 (0.43) ESR1ESR2ALOX5PTGS1PTGS2
SCHEMBL5584479 0.83 ESR1 (0.70) ESR1ESR2ALOX5GABRA1GABRB2
SCHEMBL18101029 0.83 ESR1 (0.56) ESR1ESR2MEN1KMT2ALMNA
SCHEMBL31276115 0.83 ESR1 (0.56) ESR1ESR2MEN1KMT2ALMNA
SCHEMBL15814218 0.83 ESR1 (0.50) ESR1ESR2ALOX5GABRA1GABRB2
SCHEMBL15497443 0.81 ESR1 (0.51) ESR1ESR2MEN1KMT2ALMNA

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
EP-0896975-B1 POLYCARBONATE, AND MOLDING AND ELECTROPHOTOGRAPHIC PHOTORECEPTOR PREPARED THEREFROM IDEMITSU KOSAN CO (JP) 2003-06-04 EP disclosed
EP-1288242-A2 Polycarbonate, and molding and electrophotograpic photoreceptor prepared therefrom Idemitsu Kosan Co., Ltd. (JP) 2003-03-05 EP disclosed
US-6136521-A POLYORGANOSILOXANE-CONTAINING POLYCARBONATE IDEMITSU KOSAN CO., LTD. (JP) 2000-10-24 US disclosed
EP-0896975-A1 POLYCARBONATE, AND MOLDING AND ELECTROPHOTOGRAPHIC PHOTORECEPTOR PREPARED THEREFROM IDEMITSU KOSAN COMPANY LIMITED (JP) 1999-02-17 EP disclosed