SCHEMBL7425401

SCHEMBL7425401

CCCc1c(C(=O)C(C)C)c2ccc(C(=O)OC)cc2n1Cc1ccccc1Cl

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.43
TP53 P04637 2/20 0.43
S1PR3 Q99500 4/20 0.42
DPP4 P27487 2/20 0.41
KDM4E B2RXH2 2/20 0.41
ALDH1A1 P00352 2/20 0.41
HPGD P15428 1/20 0.41
PPARG P37231 2/20 0.39
MAPK1 P28482 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
LMNA P02545 1/20 0.39
ALOX5AP P20292 1/20 0.39
PLA2G2A P14555 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
MEN1 O00255 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
KMT2A Q03164 1/20 0.39
PPARA Q07869 1/20 0.38
F2RL3 Q96RI0 1/20 0.38

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
SCHEMBL7425289 0.93 L3MBTL1 (0.44) MAPTTP53DPP4KDM4EALDH1A1
SCHEMBL7468891 0.92 MAPT (0.44) MAPTTP53S1PR3DPP4KDM4E
SCHEMBL7466262 0.91 S1PR3 (0.41) MAPTS1PR3KDM4EALDH1A1HPGD
SCHEMBL7418990 0.90 MAPT (0.44) MAPTTP53S1PR3DPP4KDM4E
SCHEMBL7425821 0.90 L3MBTL1 (0.45) MAPTTP53S1PR3DPP4KDM4E
SCHEMBL7425356 0.90 MAPT (0.44) MAPTTP53S1PR3DPP4KDM4E
SCHEMBL7465584 0.90 PPARG (0.41) MAPTTP53S1PR3KDM4EALDH1A1
SCHEMBL7421260 0.90 S1PR3 (0.40) MAPTTP53S1PR3PPARGMAPK1
SCHEMBL7418402 0.90 MAPT (0.43) MAPTTP53S1PR3DPP4KDM4E
SCHEMBL7422342 0.90 S1PR3 (0.42) MAPTS1PR3KDM4EALDH1A1PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0820441-B1 INDOLE DERIVATIVES AS cGMP-PDE INHIBITORS FUJISAWA PHARMACEUTICAL CO (JP) 2002-06-26 EP disclosed
US-6358992-B1 Method of inhibiting neoplastic cells with indole derivatives CELL PATHWAYS, INC. 2002-03-19 US disclosed
US-6069156-A Indole derivatives as cGMP-PDE inhibitors FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-05-30 US disclosed
WO-1996032379-A1 INDOLE DERIVATIVES AS cGMP-PDE INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-10-17 WO disclosed