SCHEMBL7423713

SCHEMBL7423713

CCCc1cc2ccc(C(N)=O)cc2n1Cc1ccccc1Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 2/20 0.46
PPARG P37231 1/20 0.45
TNF P01375 2/20 0.43
KDM4E B2RXH2 1/20 0.43
NOD2 Q9HC29 1/20 0.43
NOD1 Q9Y239 1/20 0.43
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
DPP4 P27487 3/20 0.42
MEN1 O00255 2/20 0.41
ALDH1A1 P00352 2/20 0.41
KMT2A Q03164 2/20 0.41
LMNA P02545 1/20 0.41
MAP3K14 Q99558 1/20 0.41
TSHR P16473 1/20 0.41
CCR2 P41597 1/20 0.41
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL4875898 0.90 PPARG (0.48) ALOX5APPPARGCCR2
SCHEMBL7422231 0.87 MAPT (0.47) PPARGTNFKDM4ENOD2NOD1
SCHEMBL7423816 0.87 AGTR1 (0.43) PPARGMEN1ALDH1A1KMT2ATSHR
SCHEMBL6170532 0.81 AGTR1 (0.55) ALOX5APPPARGTNFKDM4ENOD2
SCHEMBL7426694 0.80 MEN1 (0.46) PPARGTNFKDM4ENOD2NOD1
SCHEMBL7427183 0.79 ALOX5AP (0.44) ALOX5APTNFKDM4ENOD2NOD1
SCHEMBL7422217 0.79 CCR2 (0.46) ALOX5APDPP4MEN1ALDH1A1KMT2A
SCHEMBL7426692 0.78 ALOX5AP (0.43) ALOX5APCYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL7425637 0.78 MAPT (0.48) PPARGTNFKDM4ENOD2NOD1
SCHEMBL7670036 0.77 AGTR1 (0.57) PPARGKDM4EALDH1A1LMNATDP1

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
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