SCHEMBL7110289

SCHEMBL7110289

CCOC(=O)CNc1ccc(CCBr)cc1Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.44
MAPT P10636 4/20 0.42
KMT2A Q03164 3/20 0.42
CYP4F2 P78329 2/20 0.42
CYP4A11 Q02928 2/20 0.42
TSHR P16473 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
HTT P42858 2/20 0.41
PPIB P23284 1/20 0.40
PPIA P62937 1/20 0.40
PPID Q08752 1/20 0.40
PPIG Q13427 1/20 0.40
ADRB3 P13945 2/20 0.39
KDM4E B2RXH2 1/20 0.39
GAA P10253 1/20 0.38
POLB P06746 1/20 0.38
MEN1 O00255 2/20 0.37
HPGD P15428 1/20 0.37
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL7106985 0.88 CYP4F2 (0.51) LMNAMAPTKMT2ACYP4F2CYP4A11
SCHEMBL7103144 0.86 LMNA (0.44) LMNAMAPTKMT2ACYP4F2CYP4A11
SCHEMBL7107215 0.85 LMNA (0.44) LMNAMAPTKMT2ACYP4F2CYP4A11
SCHEMBL7103561 0.83 L3MBTL1 (0.43) LMNAMAPTCYP4F2CYP4A11TSHR
SCHEMBL7107066 0.81 L3MBTL1 (0.42) LMNAMAPTKMT2ACYP4F2CYP4A11
SCHEMBL7104581 0.79 LMNA (0.43) LMNAMAPTKMT2AL3MBTL1HTT
SCHEMBL7102017 0.78 POLB (0.56) LMNAMAPTKMT2ACYP4F2CYP4A11
SCHEMBL8082444 0.76 ADRB3 (0.72) LMNAADRB3
SCHEMBL8082439 0.76 ADRB3 (0.72) LMNAADRB3
SCHEMBL6818105 0.75 ADRB3 (0.57) KMT2ATSHRL3MBTL1ADRB3KDM4E

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
EP-1043308-B1 PHENYLAMINOALKYLCARBOXYLIC ACID DERIVATIVES AND MEDICINAL COMPOSITIONS CONTAINING THE SAME KISSEI PHARMACEUTICAL (JP) 2003-09-24 EP disclosed
US-6353025-B1 COMPOUNDS AS DRUGS KISSEI PHARMACEUTICAL CO., LTD. (JP) 2002-03-05 US disclosed
EP-1043308-A1 PHENYLAMINOALKYLCARBOXYLIC ACID DERIVATIVES AND MEDICINAL COMPOSITIONS CONTAINING THE SAME Kissei Pharmaceutical Co., Ltd. (JP) 2000-10-11 EP disclosed