SCHEMBL2500290

SCHEMBL2500290

CCCCCc1c(N)c(=O)[nH]c2ccccc12

nearest known ligand 0.66

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.66
ALDH1A1 P00352 7/20 0.66
HSD17B10 Q99714 6/20 0.66
HPGD P15428 5/20 0.66
GAA P10253 1/20 0.66
RAB9A P51151 2/20 0.60
CTSV O60911 2/20 0.52
CTSL P07711 2/20 0.52
NPC1 O15118 1/20 0.51
CYP1A2 P05177 1/20 0.51
CYP2C19 P33261 1/20 0.51
MCL1 Q07820 1/20 0.51
PARP1 P09874 1/20 0.47
MAPT P10636 1/20 0.47
HTT P42858 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
TSHR P16473 2/20 0.46
GLA P06280 1/20 0.46

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
SCHEMBL3284596 0.82 KDM4E (0.79) KDM4EALDH1A1HSD17B10HPGDGAA
SCHEMBL27743122 0.81 KDM4E (0.56) KDM4EALDH1A1HSD17B10HPGDGAA
SCHEMBL1900540 0.81 KDM4E (0.80) KDM4EALDH1A1HSD17B10HPGDGAA
SCHEMBL2754183 0.79 KDM4E (1.00) KDM4EALDH1A1HSD17B10HPGDGAA
SCHEMBL29722594 0.79 RAB9A (0.77) KDM4EALDH1A1HSD17B10HPGDGAA
SCHEMBL15338397 0.79 RAB9A (0.77) KDM4EALDH1A1HSD17B10HPGDGAA
SCHEMBL12204302 0.78 KDM4E (1.00) KDM4EALDH1A1HSD17B10HPGDGAA
SCHEMBL4921978 0.78 KDM4E (0.70) KDM4EALDH1A1HSD17B10HPGDGAA
SCHEMBL8440798 0.76 KDM4E (0.68) KDM4EALDH1A1HSD17B10HPGDGAA
SCHEMBL8444672 0.76 KDM4E (0.68) KDM4EALDH1A1HSD17B10HPGDGAA

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1888558-B1 BICYCLIC DERIVATIVES AS MODULATORS OF ION CHANNELS VERTEX PHARMA (US) 2011-10-05 EP disclosed
WO-2005008249-A1 AUTISM SCREENING TEST, METHOD OF SELECTING PATIENTS THAT RESPOND TO SAID TEST AND USE OF BKCA CHANNEL ACTIVATOR MEDICAMENTS FOR THE TREATMENT OF AUTISM UNIVERSITE FRANCOIS RABELAIS (FR) 2005-01-27 WO disclosed
US-20030211547-A1 Large conductance calcium-dependent potassium channel as modulator of alcohol effects and consumption MCINTIRE STEVEN L (US) 2003-11-13 US disclosed
EP-1011677-A4 4-ARYL-3-AMINOQUINOLINE-2-ONE DERIVATIVES AS POTASSIUM CHANNEL MODULATORS BRISTOL MYERS SQUIBB CO (US) 2002-03-20 EP disclosed
EP-1011677-A4 4-ARYL-3-AMINOQUINOLINE-2-ONE DERIVATIVES AS POTASSIUM CHANNEL MODULATORS BRISTOL MYERS SQUIBB CO (US) 2002-03-20 EP disclosed
WO-2001094375-A1 LARGE CONDUCTANCE CALCIUM-DEPENDENT POTASSIUM CHANNEL AS MODULATOR OF ALCOHOL EFFECTS AND CONSUMPTION MCINTIRE STEVEN L (US) 2001-12-13 WO disclosed
EP-1011677-A1 4-ARYL-3-AMINOQUINOLINE-2-ONE DERIVATIVES AS POTASSIUM CHANNEL MODULATORS Bristol-Myers Squibb Company (US) 2000-06-28 EP disclosed
EP-1011677-A1 4-ARYL-3-AMINOQUINOLINE-2-ONE DERIVATIVES AS POTASSIUM CHANNEL MODULATORS Bristol-Myers Squibb Company (US) 2000-06-28 EP disclosed
US-5972961-A ANTIISCHEMIC AGENTS; ANTICONVULSANTS; HEADACHES; SEXUAL DISORDERS BRISTOL-MYERS SQUIBB COMPANY (US) 1999-10-26 US disclosed
US-5972961-A ANTIISCHEMIC AGENTS; ANTICONVULSANTS; HEADACHES; SEXUAL DISORDERS BRISTOL-MYERS SQUIBB COMPANY (US) 1999-10-26 US disclosed
US-5972961-A ANTIISCHEMIC AGENTS; ANTICONVULSANTS; HEADACHES; SEXUAL DISORDERS BRISTOL-MYERS SQUIBB COMPANY (US) 1999-10-26 US disclosed
WO-1999009983-A1 4-ARYL-3-AMINOQUINOLINE-2-ONE DERIVATIVES AS POTASSIUM CHANNEL MODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 1999-03-04 WO disclosed
WO-1999009983-A1 4-ARYL-3-AMINOQUINOLINE-2-ONE DERIVATIVES AS POTASSIUM CHANNEL MODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 1999-03-04 WO disclosed