SCHEMBL7427464

SCHEMBL7427464

CCC(=O)c1[nH]c2cc(C(=O)OC)ccc2c1CC

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 2/20 0.57
KMT2A Q03164 5/20 0.50
MEN1 O00255 4/20 0.50
PARP1 P09874 3/20 0.50
RAB9A P51151 1/20 0.49
ATM Q13315 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
ALDH1A1 P00352 5/20 0.46
KDM4E B2RXH2 3/20 0.46
PKM P14618 2/20 0.46
HSD17B10 Q99714 2/20 0.46
GAA P10253 2/20 0.46
HPGD P15428 2/20 0.46
GLA P06280 1/20 0.46
HTT P42858 1/20 0.46
DYRK1A Q13627 1/20 0.46
CSNK2A1 P68400 1/20 0.45
NPC1 O15118 1/20 0.45
POLB P06746 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL7421706 0.90 KMT2A (0.57) KIF11KMT2AMEN1PARP1RAB9A
SCHEMBL7541380 0.84 KIF11 (0.56) KIF11KMT2AMEN1PARP1RAB9A
SCHEMBL29708168 0.80 KIF11 (0.84) KIF11KMT2AMEN1PARP1RAB9A
SCHEMBL4725998 0.80 KIF11 (0.84) KIF11KMT2AMEN1PARP1RAB9A
SCHEMBL7415956 0.79 KIF11 (0.53) KIF11KMT2AMEN1PARP1RAB9A
SCHEMBL7422570 0.77 KIF11 (0.55) KIF11KMT2AMEN1PARP1RAB9A
SCHEMBL7415906 0.75 KMT2A (0.55) KIF11KMT2AMEN1PARP1RAB9A
SCHEMBL7419842 0.74 KMT2A (0.60) KIF11KMT2AMEN1PARP1RAB9A
SCHEMBL7419386 0.74 KIF11 (0.51) KIF11KMT2AMEN1PARP1RAB9A
SCHEMBL18705582 0.73 KIF11 (0.56) KIF11KMT2AMEN1PARP1RAB9A

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 6 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
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