SCHEMBL27263178

SCHEMBL27263178

Cc1csc(Cn2cccc2C(=O)O)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DAO P14920 2/20 0.40
PRSS1 P07477 1/20 0.40
TMPRSS15 P98073 1/20 0.40
KDM4C Q9H3R0 1/20 0.39
CNR1 P21554 1/20 0.37
CNR2 P34972 1/20 0.37
EPHX2 P34913 7/20 0.37
METAP2 P50579 1/20 0.37
KDM4E B2RXH2 1/20 0.36
PPARG P37231 1/20 0.36
LMNA P02545 2/20 0.35
MAP3K14 Q99558 1/20 0.35
AVPR2 P30518 1/20 0.34
OXTR P30559 1/20 0.34
AVPR1A P37288 1/20 0.34
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
ALOX12 P18054 1/20 0.34
RECQL P46063 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
SCHEMBL9022464 0.76 CNR2 (0.46) CNR1CNR2EPHX2KDM4ECA12
SCHEMBL9022900 0.76 CYP2C19 (0.49) DAOPRSS1TMPRSS15EPHX2LMNA
SCHEMBL9022822 0.75 MEN1 (0.43) CNR1CNR2EPHX2KDM4EPPARG
SCHEMBL12926197 0.74 KDM4E (0.54) EPHX2KDM4ELMNAALDH1A1MAPT
SCHEMBL24434970 0.71 KDM4E (0.43) CNR1CNR2EPHX2KDM4EPPARG
SCHEMBL9022216 0.71 HDAC8 (0.57) CNR1CNR2EPHX2KDM4EMEN1
SCHEMBL11490984 0.70 LMNA (0.43) CNR1CNR2EPHX2KDM4EPPARG
SCHEMBL1607395 0.70 CNR2 (0.57) CNR2EPHX2KDM4ELMNAMAP3K14
SCHEMBL9029786 0.70 L3MBTL1 (0.41) CNR1CNR2EPHX2KDM4EPPARG
SCHEMBL29229 0.69 LMNA (0.44) EPHX2PPARGLMNAMAP3K14MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1022754-C Novel aryl-or heteroaryl-1-alkyl-pyrrole-2-carboxylic acid compounds preparation method MERRELL DOW PHARMA (US) 1993-11-17 CN disclosed
CN-1044653-A The new aryl or the heteroaryl-I-alkyl-pyrroles-2-carboxylic acid that are used for the treatment of the pathological state of interleukin-I mediation MERRELL DOW PHARMA (US) 1990-08-15 CN disclosed