SCHEMBL7473716

SCHEMBL7473716

COCc1[nH]c2cc(C(=O)OC)ccc2c1C(=O)C(C)C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 2/20 0.50
PARP1 P09874 3/20 0.47
KMT2A Q03164 5/20 0.46
KDM4E B2RXH2 3/20 0.46
ALDH1A1 P00352 3/20 0.46
PKM P14618 2/20 0.46
GAA P10253 2/20 0.46
HTT P42858 2/20 0.46
HSD17B10 Q99714 2/20 0.46
GLA P06280 1/20 0.46
HPGD P15428 1/20 0.46
RAB9A P51151 2/20 0.46
MEN1 O00255 4/20 0.45
NPC1 O15118 2/20 0.45
ATM Q13315 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
DYRK1A Q13627 1/20 0.44
CSNK2A1 P68400 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
POLB P06746 1/20 0.41

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
SCHEMBL7467512 0.89 KIF11 (0.51) KIF11PARP1KMT2AKDM4EALDH1A1
SCHEMBL7421225 0.88 KIF11 (0.50) KIF11PARP1KMT2AKDM4EALDH1A1
SCHEMBL7422800 0.87 KMT2A (0.58) KIF11PARP1KMT2AKDM4EALDH1A1
SCHEMBL7419362 0.82 KIF11 (0.55) KIF11PARP1KMT2AKDM4EALDH1A1
SCHEMBL7418777 0.78 KMT2A (0.48) KIF11PARP1KMT2AKDM4EALDH1A1
SCHEMBL7418840 0.77 PARP1 (0.49) KIF11PARP1KMT2AKDM4EALDH1A1
SCHEMBL7467799 0.77 PARP1 (0.49) KIF11PARP1KMT2AKDM4EALDH1A1
SCHEMBL7470065 0.77 MEN1 (0.68) KIF11KMT2AKDM4EALDH1A1HSD17B10
SCHEMBL7423919 0.75 KMT2A (0.46) KIF11PARP1KMT2AKDM4EALDH1A1
SCHEMBL7422740 0.74 KIF11 (0.55) KIF11PARP1KMT2AKDM4EALDH1A1

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
CN-1187812-A Indole derivatives as CGMP-PDE inhibitors FUJISAWA PHARMACEUTICAL CO (JP) 1998-07-15 CN disclosed
WO-1996032379-A1 INDOLE DERIVATIVES AS cGMP-PDE INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-10-17 WO disclosed