SCHEMBL7473427

SCHEMBL7473427

COC(=O)c1ccc2c3c(n(Cc4ccccc4Cl)c2c1)CCC3=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.46
MAPT P10636 7/20 0.45
TP53 P04637 3/20 0.45
HDAC1 Q13547 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
LMNA P02545 1/20 0.43
MAPK1 P28482 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ALDH1A1 P00352 2/20 0.42
KDM4E B2RXH2 1/20 0.42
HPGD P15428 1/20 0.42
FABP4 P15090 1/20 0.41
POLB P06746 1/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
PLA2G2A P14555 1/20 0.40
RXFP1 Q9HBX9 3/20 0.40
CNR2 P34972 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
SCHEMBL7474547 0.94 HDAC1 (0.52) DPP4MAPTTP53HDAC1HDAC6
SCHEMBL7418839 0.88 FABP4 (0.54) DPP4HDAC1HDAC6ALDH1A1FABP4
SCHEMBL7414769 0.87 HDAC1 (0.46) DPP4TP53HDAC1HDAC6LMNA
SCHEMBL7470778 0.86 DPP4 (0.46) DPP4MAPTTP53LMNAMAPK1
SCHEMBL7422984 0.82 DPP4 (0.47) DPP4MAPTTP53LMNAMAPK1
SCHEMBL7422336 0.82 FABP4 (0.57) DPP4HDAC1HDAC6ALDH1A1KDM4E
SCHEMBL7428003 0.81 HDAC1 (0.54) DPP4TP53HDAC1HDAC6ALDH1A1
SCHEMBL7428023 0.77 MAPT (0.47) DPP4MAPTTP53LMNAMAPK1
SCHEMBL7472560 0.76 MAPT (0.49) DPP4MAPTTP53LMNAMAPK1
SCHEMBL7426911 0.76 MAPT (0.47) DPP4MAPTTP53LMNAMAPK1

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