SCHEMBL7415958

SCHEMBL7415958

CCC(O)c1c(C(=O)C(C)C)c2ccc(C(=O)O)cc2n1Cc1ccccc1Cl

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 3/20 0.43
S1PR3 Q99500 3/20 0.42
TP53 P04637 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
PPARG P37231 1/20 0.42
SLC22A12 Q96S37 3/20 0.42
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
KMT2A Q03164 1/20 0.41
EGLN3 Q9H6Z9 1/20 0.40
PTPN11 Q06124 1/20 0.40
DPP4 P27487 2/20 0.39
PTGES O14684 1/20 0.39
ALOX5 P09917 1/20 0.39
LTC4S Q16873 1/20 0.39
CCR2 P41597 1/20 0.39

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
SCHEMBL7427098 0.91 ALOX5AP (0.44) ALOX5APS1PR3TP53RXFP1PPARG
SCHEMBL7428819 0.85 ALOX5AP (0.47) ALOX5APTP53RXFP1PPARGSLC22A12
SCHEMBL7469713 0.85 L3MBTL1 (0.52) ALOX5APTP53RXFP1PPARGSLC22A12
SCHEMBL7427533 0.83 ALOX5AP (0.46) ALOX5APTP53RXFP1PPARGSLC22A12
SCHEMBL7707842 0.82 ALOX5AP (0.45) ALOX5APTP53RXFP1PPARGSLC22A12
SCHEMBL7418727 0.82 ALOX5AP (0.53) ALOX5APSLC22A12PTPN11DPP4PTGES
SCHEMBL7472045 0.81 ALOX5AP (0.46) ALOX5APTP53RXFP1SLC22A12MEN1
SCHEMBL7475969 0.80 ALOX5AP (0.43) ALOX5APTP53RXFP1SLC22A12MEN1
SCHEMBL7424396 0.80 ALOX5AP (0.43) ALOX5APTP53RXFP1SLC22A12MEN1
SCHEMBL7419644 0.78 S1PR3 (0.44) S1PR3TP53PPARGALDH1A1DPP4

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