SCHEMBL9075783

SCHEMBL9075783

CCCC(c1ccccc1C)c1ccccc1OC(=O)Oc1ccccc1C(CCC)c1ccccc1C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.40
KDM4E B2RXH2 3/20 0.40
HPGD P15428 2/20 0.40
HSD17B10 Q99714 1/20 0.40
L3MBTL1 Q9Y468 3/20 0.39
POLB P06746 3/20 0.39
HTT P42858 2/20 0.39
NPSR1 Q6W5P4 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
RECQL P46063 1/20 0.38
TSHR P16473 1/20 0.37
GLA P06280 1/20 0.37
ATM Q13315 1/20 0.37
CYP19A1 P11511 1/20 0.37
ALDH1A1 P00352 1/20 0.36
PTGES O14684 1/20 0.36
ALOX5 P09917 1/20 0.36
PPARG P37231 1/20 0.36
PPARA Q07869 1/20 0.36

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
SCHEMBL9075787 0.91 TDP1 (0.40) TDP1KDM4EHPGDL3MBTL1POLB
SCHEMBL9076605 0.85 TSHR (0.40) TDP1KDM4EHPGDHSD17B10L3MBTL1
SCHEMBL6745678 0.85 KDM4E (0.41) TDP1KDM4EHPGDHSD17B10L3MBTL1
SCHEMBL9330275 0.80 CYP19A1 (0.49) POLBNPSR1TSHRCYP19A1ESR1
Ammonia Solution, Strong SCHEMBL5725582 0.79 CYP19A1 (0.47) POLBNPSR1TSHRCYP19A1ESR1
SCHEMBL9076618 0.77 TSHR (0.40) TDP1KDM4EHPGDHSD17B10L3MBTL1
SCHEMBL6745681 0.76 MEN1 (0.40) TDP1KDM4EHPGDHSD17B10L3MBTL1
SCHEMBL15104782 0.73 PTGS2 (0.39) KDM4EHPGDHSD17B10L3MBTL1MEN1
SCHEMBL5683949 0.73 TSHR (0.47) TDP1KDM4EHPGDHSD17B10L3MBTL1
Diethylamine SCHEMBL11101289 0.73 CYP19A1 (0.43) POLBHTTNPSR1RECQLCYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0434998-B1 Polycarbonate or polyestercarbonate resin compositions and preparing methods thereof G E PLASTICS JAPAN LTD (JP) 1996-02-07 EP disclosed
US-5459225-A Ester interchange in antioxidant presence IDEMITSU PETROCHEMICAL CO., LTD. (JP) 1995-10-17 US disclosed
US-5349042-A Ester interchange and dechlorination with carbonation IDEMITSU PETROCHEMICAL CO., LTD. (JP) 1994-09-20 US disclosed
EP-0561363-A2 Process for producing polycarbonate IDEMITSU PETROCHEMICAL CO. LTD. (JP) 1993-09-22 EP disclosed
US-5187242-A Workable molding materials containing aliphatic carboxylic acids and aromatic diols as monomers, impact strenth, transparency GENERAL ELECTRIC COMPANY (US) 1993-02-16 US disclosed
EP-0434998-A2 Polycarbonate or polyestercarbonate resin compositions and preparing methods thereof GE PLASTICS JAPAN LIMITED (JP) 1991-07-03 EP disclosed