SCHEMBL7422715

SCHEMBL7422715

CCCc1c(C#N)c2ccc(C(=O)O)cc2n1Cc1ccccc1Cl

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 3/20 0.42
ALDH1A1 P00352 2/20 0.42
KDM4E B2RXH2 1/20 0.42
MAPT P10636 1/20 0.42
CCR2 P41597 2/20 0.41
PTPN11 Q06124 1/20 0.40
ALOX5AP P20292 1/20 0.40
DPP4 P27487 2/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 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
SCHEMBL7423371 0.91 ALDH1A1 (0.41) ALDH1A1KDM4EMAPTCCR2ALOX5AP
SCHEMBL7416354 0.89 MAPT (0.43) ALDH1A1KDM4EMAPTDPP4MEN1
SCHEMBL7419326 0.85 SLC22A12 (0.45) SLC22A12ALDH1A1CCR2PTPN11ALOX5AP
SCHEMBL150104 0.84 L3MBTL1 (0.47) SLC22A12ALDH1A1CCR2PTPN11ALOX5AP
SCHEMBL7463685 0.84 ALOX5AP (0.44) SLC22A12ALDH1A1CCR2PTPN11ALOX5AP
SCHEMBL7418877 0.83 SLC22A12 (0.43) SLC22A12ALDH1A1KDM4EMAPTCCR2
SCHEMBL7421444 0.83 KMT2A (0.54) SLC22A12ALDH1A1MAPTCCR2PTPN11
SCHEMBL7427533 0.82 ALOX5AP (0.46) SLC22A12ALDH1A1CCR2PTPN11ALOX5AP
SCHEMBL7425629 0.81 KMT2A (0.44) SLC22A12ALDH1A1MAPTCCR2PTPN11
SCHEMBL7707842 0.81 ALOX5AP (0.45) SLC22A12ALDH1A1CCR2PTPN11ALOX5AP

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