SCHEMBL3281277

SCHEMBL3281277

CCNC(=O)Nc1ccc(Oc2ccc(-c3c[nH]c(COc4ccccc4)n3)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTNR1B P49286 1/20 0.49
MAPK14 Q16539 1/20 0.42
NAMPT P43490 1/20 0.42
ABL1 P00519 1/20 0.42
ALOX5 P09917 1/20 0.41
EPHX2 P34913 1/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
CRHBP P24387 1/20 0.41
CRHR2 Q13324 1/20 0.41
NOX1 Q9Y5S8 1/20 0.41
FLT1 P17948 1/20 0.41
KDR P35968 1/20 0.41
MCL1 Q07820 1/20 0.41
GBA1 P04062 1/20 0.41
ROCK2 O75116 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 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
Trifluoroacetic Acid SCHEMBL3270278 0.95 MTNR1B (0.45) MTNR1BMAPK14NAMPTABL1ALOX5
SCHEMBL3269527 0.91 ALOX5 (0.50) MAPK14ALOX5EPHX2NPC1RAB9A
SCHEMBL3278196 0.91 KMT2A (0.47) NAMPTMAPTKDRROCK2MCHR1
SCHEMBL3275815 0.89 GBA1 (0.46) MAPK14ALOX5EPHX2NPC1RAB9A
SCHEMBL3270368 0.88 NPC1 (0.52) NPC1RAB9AMAPTHPGDCYP2C19
SCHEMBL4457369 0.88 MEN1 (0.48) MTNR1BMAPTHPGDMCL1CYP2C19
SCHEMBL3270529 0.87 MAPK1 (0.47) MAPK14ALOX5EPHX2HPGDMCL1
SCHEMBL3273871 0.87 NPC1 (0.50) MAPK14NAMPTNPC1RAB9AHPGD
SCHEMBL3270361 0.87 MCL1 (0.40) MTNR1BABL1NPC1RAB9AMAPT
Trifluoroacetic Acid SCHEMBL3269765 0.86 KMT2A (0.43) EPHX2MAPTKDRROCK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2024335-B1 NOVEL IMIDAZOLE DERIVATIVES, PREPARATION AND USER THEREOF AS MEDICINE IPSEN PHARMA (FR) 2010-06-23 EP disclosed
EP-2024335-A1 NOVEL IMIDAZOLE DERIVATIVES, PREPARATION AND USER THEREOF AS MEDICINE Societe de Conseils de Recherches et d'Applications Scientifique (FR) 2009-02-18 EP disclosed
WO-2007125197-A1 NOVEL IMIDAZOLE DERIVATIVES, PREPARATION AND USER THEREOF AS MEDICINE SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUE (S.C.R.A.S.) (FR) 2007-11-08 WO disclosed