SCHEMBL7425637

SCHEMBL7425637

CCc1cc2ccc(C(=O)OC)cc2n1Cc1ccccc1Cl

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.48
TP53 P04637 1/20 0.48
MEN1 O00255 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
KMT2A Q03164 1/20 0.44
MAPK1 P28482 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
DPP4 P27487 2/20 0.44
LMNA P02545 1/20 0.44
KDM4E B2RXH2 3/20 0.43
ALDH1A1 P00352 2/20 0.43
TDP1 Q9NUW8 1/20 0.43
HPGD P15428 1/20 0.43
TNF P01375 2/20 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

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
SCHEMBL7422231 0.91 MAPT (0.47) MAPTTP53MEN1NPC1RAB9A
SCHEMBL5881804 0.88 LMNA (0.49) MAPTTP53MEN1NPC1RAB9A
SCHEMBL7424836 0.87 MAPT (0.45) MAPTTP53MEN1NPC1RAB9A
SCHEMBL5882680 0.86 MAPT (0.53) MAPTTP53MEN1NPC1RAB9A
SCHEMBL8006723 0.86 MAPT (0.44) MAPTTP53MEN1NPC1RAB9A
SCHEMBL7420224 0.86 MAPT (0.44) MAPTTP53MEN1NPC1RAB9A
SCHEMBL5882106 0.82 MTNR1A (0.49) MAPTTP53MEN1KMT2AMTNR1A
SCHEMBL7428023 0.79 MAPT (0.47) MAPTTP53MEN1NPC1RAB9A
SCHEMBL4875898 0.79 PPARG (0.48) NPC1RAB9APPARGCCR2
SCHEMBL7418922 0.78 PTGDR2 (0.41) MAPTMEN1NPC1RAB9AKMT2A

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 2 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
WO-1996032379-A1 INDOLE DERIVATIVES AS cGMP-PDE INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-10-17 WO disclosed