SCHEMBL4607511

SCHEMBL4607511

N#CCC(c1ccc(O)cc1)c1ccc(O)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 11/20 0.58
ESR2 Q92731 10/20 0.58
CYP1A2 P05177 2/20 0.47
CYP3A4 P08684 2/20 0.47
CYP2C9 P11712 2/20 0.47
CYP2C19 P33261 2/20 0.47
ALDH1A1 P00352 2/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
LMNA P02545 1/20 0.41
PGR P06401 1/20 0.41
CHRM2 P08172 1/20 0.41
ADORA3 P0DMS8 1/20 0.41
AR P10275 1/20 0.41
CYP2D6 P10635 1/20 0.41
MAPT P10636 1/20 0.41
CHRM1 P11229 1/20 0.41
ALOX15 P16050 1/20 0.41
DRD1 P21728 1/20 0.41
TBXA2R P21731 1/20 0.41

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
SCHEMBL28409824 0.82 ESR1 (0.75) ESR1ESR2CYP1A2CYP3A4CYP2C9
SCHEMBL4944014 0.78 ESR1 (0.48) ESR1ESR2CYP1A2CYP3A4CYP2C9
SCHEMBL3952853 0.78 PBRM1 (0.47) ALDH1A1MEN1KMT2ALMNATDP1
Water SCHEMBL5164513 0.78 PBRM1 (0.47) ALDH1A1MEN1KMT2ALMNATDP1
SCHEMBL4619082 0.77 CNR1 (0.43) ESR1ESR2CYP1A2CYP3A4CYP2C9
SCHEMBL21001807 0.77 ESR1 (0.40) ESR1ESR2CYP3A4ALDH1A1MEN1
SCHEMBL13930328 0.77 ALDH1A1 (0.41) ESR1ESR2CYP2C19ALDH1A1LMNA
SCHEMBL4919512 0.77 SMN1; SMN2 (0.40) ESR1ESR2ALDH1A1LMNATDP1
SCHEMBL9702595 0.77 ESR1 (0.47) ESR1ESR2CYP1A2CYP3A4CYP2C9
SCHEMBL11552543 0.75 ESR1 (0.51) ESR1ESR2CYP1A2CYP3A4CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1971631-A1 THERMALLY STABLE POLYCARBONATES, THERMOPLASTIC COMPOSITIONS THEREOF, AND ARTICLES FORMED THEREFROM GENERAL ELECTRIC COMPANY (US) 2008-09-24 EP disclosed
EP-1945695-A2 METHOD OF IMPROVING ABRASION RESISTANCE OF PLASTIC ARTICLE USING NANOPARTICLES AND ARTICLE PRODUCED THEREBY General Electric Company (US) 2008-07-23 EP disclosed
EP-1945693-A1 POLYARYLATE-SILOXANE COPOLYMERS Momentive Performance Materials Inc. (US) 2008-07-23 EP disclosed
WO-2008019149-A1 COMPOSITION AND ASSOCIATED METHOD MOMENTIVE PERFORMANCE MATERIALS INC. (US) 2008-02-14 WO disclosed
WO-2008019151-A1 OXETANE COMPOSITION, ASSOCIATED METHOD AND ARTICLE MOMENTIVE PERFORMANCE MATERIALS INC. (US) 2008-02-14 WO disclosed
EP-1833872-A1 CARBOXY-TERMINATED OLIGOMERIC POLYESTER COMPOSITIONS AND METHOD FOR MAKING General Electric Company (US) 2007-09-19 EP disclosed
WO-2006044575-A9 METHOD FOR THE PREPARATION OF ALIPHATIC CHLOROFORMATES GEN ELECTRIC (US) 2007-08-23 WO disclosed
WO-2007081593-A1 THERMALLY STABLE POLYCARBONATES, THERMOPLASTIC COMPOSITIONS THEREOF, AND ARTICLES FORMED THEREFROM GENERAL ELECTRIC COMPANY (US) 2007-07-19 WO disclosed
EP-1805130-A1 METHOD FOR THE PREPARATION OF ALIPHATIC CHLOROFORMATES General Electric Company, (a New York Corporation) (US) 2007-07-11 EP disclosed
WO-2007047083-A1 POLYARYLATE-SILOXANE COPOLYMERS MOMENTIVE PERFORMANCE MATERIALS INC. (US) 2007-04-26 WO disclosed
WO-2007047294-A2 METHOD OF IMPROVING ABRASION RESISTANCE OF PLASTIC ARTICLE USING NANOPARTICLES AND ARTICLE PRODUCED THEREBY GENERAL ELECTRIC COMPANY (US) 2007-04-26 WO disclosed
WO-2006057810-A1 CARBOXY-TERMINATED OLIGOMERIC POLYESTER COMPOSITIONS AND METHOD FOR MAKING GENERAL ELECTRIC COMPANY (US) 2006-06-01 WO disclosed
WO-2006044575-A1 METHOD FOR THE PREPARATION OF ALIPHATIC CHLOROFORMATES GENERAL ELECTRIC COMPANY (US) 2006-04-27 WO disclosed