SCHEMBL4057010

SCHEMBL4057010

COCc1cc(Br)ccc1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.46
GFER P55789 1/20 0.46
ALDH1A1 P00352 6/20 0.46
PRKCE Q02156 3/20 0.46
MEN1 O00255 3/20 0.46
MAPT P10636 3/20 0.46
KMT2A Q03164 3/20 0.46
MYLK Q15746 2/20 0.46
RECQL P46063 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
PRKCG P05129 1/20 0.46
PRKCA P17252 1/20 0.46
APEX1 P27695 1/20 0.46
ALOX15 P16050 3/20 0.45
HTT P42858 4/20 0.44
KDM4E B2RXH2 3/20 0.44
CASP1 P29466 2/20 0.44
USP2 O75604 1/20 0.44
GAA P10253 1/20 0.44
THRB P10828 1/20 0.44

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
SCHEMBL6712520 0.81 PRKCE (0.50) ALDH1A1PRKCEMEN1MAPTKMT2A
SCHEMBL4588928 0.81 POLB (0.41) ALDH1A1PRKCEMEN1MAPTKMT2A
SCHEMBL30517254 0.81 POLB (0.41) ALDH1A1PRKCEMEN1MAPTKMT2A
SCHEMBL25446709 0.78 PRKCE (0.47) TSHRALDH1A1PRKCEMEN1MAPT
SCHEMBL20633523 0.78 FFAR4 (0.40) ALDH1A1PRKCEMEN1MAPTKMT2A
SCHEMBL2220733 0.78 AMY1A (0.55) ALDH1A1PRKCEMEN1MAPTKMT2A
SCHEMBL30396162 0.77 ALDH1A1 (0.54) TSHRGFERALDH1A1ALOX15HTT
SCHEMBL82273 0.77 ALDH1A1 (0.54) TSHRGFERALDH1A1ALOX15HTT
SCHEMBL68224 0.76 ALOX15 (0.54) TSHRGFERALDH1A1MEN1MAPT
SCHEMBL4631441 0.76 PRKCE (0.46) ALDH1A1PRKCEMEN1MAPTKMT2A

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
WO-2009106565-A1 AGONISTS OF GPR119 BIOVITRUM AB (PUBL) (SE) 2009-09-03 WO disclosed
WO-2009106565-A1 AGONISTS OF GPR119 BIOVITRUM AB (PUBL) (SE) 2009-09-03 WO disclosed
WO-2003074044-A1 SUBSTITUTED BENZOPYRANS AS SELECTIVE ESTROGEN RECEPTOR-BETA AGONISTS ELI LILLY AND COMPANY (US) 2003-09-12 WO disclosed
EP-0860433-B1 QUINOLINE DERIVATIVES AND QUINAZOLINE DERIVATIVES INHIBITING AUTOPHOSPHORYLATION OF GROWTH FACTOR RECEPTOR ORIGINATING IN PLATELET AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME KIRIN BREWERY (JP) 2002-07-03 EP disclosed
US-6143764-A ETHER DERIVATIVES OF QUINOLINE, ANTITUMOR AGENTS KIRIN BEER KABUSHIKI KAISHA (JP) 2000-11-07 US disclosed
EP-0860433-A1 QUINOLINE DERIVATIVES AND QUINAZOLINE DERIVATIVES INHIBITING AUTOPHOSPHORYLATION OF GROWTH FACTOR RECEPTOR ORIGINATING IN PLATELET AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME KIRIN BEER KABUSHIKI KAISHA (JP) 1998-08-26 EP disclosed