SCHEMBL7419765

SCHEMBL7419765

CCCc1c(C(=O)C(C)C)c2ccc(C(N)=O)cc2n1Cc1ccccc1C(N)=O

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 3/20 0.39
NPC1 O15118 3/20 0.38
PPARG P37231 4/20 0.37
FABP4 P15090 1/20 0.36
ALOX5AP P20292 1/20 0.36
DPP4 P27487 4/20 0.35
S1PR3 Q99500 2/20 0.34
CNR2 P34972 1/20 0.34
KMT2A Q03164 1/20 0.33

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
SCHEMBL7423617 0.94 PLA2G2A (0.40) PLA2G2ANPC1PPARGFABP4DPP4
SCHEMBL7470934 0.92 PLA2G2A (0.38) PLA2G2ANPC1S1PR3KMT2A
SCHEMBL7472399 0.90 ALDH1A1 (0.39) PLA2G2ANPC1ALOX5APCNR2KMT2A
SCHEMBL7481829 0.89 MAPT (0.41) PLA2G2AS1PR3CNR2KMT2A
SCHEMBL7422125 0.89 AGTR1 (0.39) PLA2G2ANPC1ALOX5APDPP4CNR2
SCHEMBL7420760 0.89 PLA2G2A (0.38) PLA2G2ANPC1ALOX5APDPP4S1PR3
SCHEMBL687131 0.89 ALOX5AP (0.47) PLA2G2APPARGALOX5APDPP4CNR2
Hydrochloric Acid SCHEMBL7418164 0.89 PLA2G2A (0.38) PLA2G2ANPC1ALOX5APDPP4S1PR3
SCHEMBL29611861 0.89 ALOX5AP (0.47) PLA2G2APPARGALOX5APDPP4CNR2
SCHEMBL7476214 0.88 PLA2G2A (0.51) PLA2G2ANPC1PPARGDPP4

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 5 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
EP-0820441-A1 INDOLE DERIVATIVES AS cGMP-PDE INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-01-28 EP disclosed
WO-1996032379-A1 INDOLE DERIVATIVES AS cGMP-PDE INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-10-17 WO disclosed