SCHEMBL7961176

SCHEMBL7961176

CCCCCC(=O)NCCCc1c[nH]cn1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FAAH O00519 3/20 0.50
HPGD P15428 1/20 0.45
DNM1 Q05193 2/20 0.44
MTNR1A P48039 1/20 0.44
CASP2 P42575 1/20 0.44
TRPV1 Q8NER1 3/20 0.43
HSD17B10 Q99714 1/20 0.43
MEN1 O00255 1/20 0.43
MAPT P10636 1/20 0.43
KMT2A Q03164 1/20 0.43
GPR119 Q8TDV5 1/20 0.43
CNR1 P21554 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
SCHEMBL7971173 0.99 FAAH (0.52) FAAHHPGDDNM1MTNR1ACASP2
SCHEMBL7977295 0.99 FAAH (0.52) FAAHHPGDDNM1MTNR1ACASP2
SCHEMBL17817370 0.92 FAAH (0.50) FAAHDNM1MTNR1ATRPV1HSD17B10
SCHEMBL17952398 0.89 CASP2 (0.51) FAAHHPGDDNM1MTNR1ACASP2
SCHEMBL18871254 0.89 CASP2 (0.51) FAAHHPGDDNM1MTNR1ACASP2
SCHEMBL17473832 0.86 HDAC3 (0.41) MTNR1AMEN1MAPTKMT2A
SCHEMBL18381452 0.85 LMNA (0.49) MEN1MAPTKMT2A
SCHEMBL27781538 0.83 GAA (0.43) HPGDMTNR1AHSD17B10MEN1KMT2A
SCHEMBL7776365 0.83 HPGD (0.47) HPGDMTNR1ACASP2
SCHEMBL12792322 0.83 CASP2 (0.44) FAAHHPGDDNM1MTNR1ACASP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE37303-E1 Imidazole compounds and their therapeutic applications INSTITUT NATIONAL DEL LA SANTE ET DE LA RECHERCHE MEDICALE (FR) 2001-07-31 US claimed
US-5708171-A HISTAMINE H3-RECEPTOR ANTAGONIST INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (FR) 1998-01-13 US claimed
EP-0597088-A1 NOVEL IMIDAZOLE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC APPLICATIONS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 1994-05-18 EP claimed
WO-1993014070-A2 NOVEL IMIDAZOLE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC APPLICATIONS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (FR) 1993-07-22 WO claimed
US-5708171-A HISTAMINE H3-RECEPTOR ANTAGONIST INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (FR) 1998-01-13 US disclosed
EP-0597088-A1 NOVEL IMIDAZOLE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC APPLICATIONS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 1994-05-18 EP disclosed
WO-1993014070-A2 NOVEL IMIDAZOLE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC APPLICATIONS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (FR) 1993-07-22 WO disclosed