SCHEMBL7423222

SCHEMBL7423222

N#Cc1ccc2c3c(n(Cc4ccccc4Cl)c2c1)C(=O)CCC3

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.44
KCNH2 Q12809 1/20 0.44
ALDH1A1 P00352 5/20 0.43
KDM4E B2RXH2 3/20 0.43
MAPK1 P28482 2/20 0.43
HSD17B10 Q99714 2/20 0.43
HTT P42858 1/20 0.43
MAPT P10636 2/20 0.42
LMNA P02545 1/20 0.42
HPGD P15428 1/20 0.42
HSD11B1 P28845 2/20 0.41
ALOX5AP P20292 9/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
TP53 P04637 1/20 0.37
CREBBP Q92793 1/20 0.37

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
SCHEMBL7416251 0.81 ALDH1A1 (0.54) DPP4ALDH1A1KDM4EMAPK1HSD17B10
SCHEMBL7423051 0.80 DPP4 (0.45) DPP4ALDH1A1KDM4EMAPK1HSD17B10
SCHEMBL7422984 0.78 DPP4 (0.47) DPP4ALDH1A1KDM4EMAPK1HSD17B10
SCHEMBL7424979 0.74 FABP4 (0.51) DPP4ALDH1A1KDM4EHSD17B10HPGD
SCHEMBL7467571 0.74 DPP4 (0.44) DPP4ALDH1A1LMNAALOX5APMEN1
SCHEMBL7470778 0.71 DPP4 (0.46) DPP4ALDH1A1KDM4EMAPK1MAPT
SCHEMBL7423106 0.68 ALOX5AP (0.42) DPP4KCNH2ALDH1A1KDM4EMAPT
SCHEMBL7428288 0.67 ALOX5AP (0.47) DPP4KCNH2ALDH1A1KDM4EHTT
SCHEMBL10911638 0.67 TP53 (0.52) ALDH1A1KDM4EMAPK1HSD17B10HTT
SCHEMBL7371677 0.67 ALDH1A1 (0.45) DPP4ALDH1A1KDM4EMAPK1HSD17B10

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