SCHEMBL7975013

SCHEMBL7975013

C[C@H](CC(=O)NCCCc1c[nH]cn1)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.56
ALDH1A1 P00352 2/20 0.56
POLB P06746 1/20 0.51
HRH2 P25021 6/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
KMT2A Q03164 1/20 0.44
KCNA5 P22460 2/20 0.43
RAB9A P51151 2/20 0.41
NPC1 O15118 1/20 0.41
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HRH4 Q9H3N8 4/20 0.41
HRH3 Q9Y5N1 3/20 0.41
HRH1 P35367 2/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C19 P33261 1/20 0.41
TACR1 P25103 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
SCHEMBL7975015 1.00 HPGD (0.56) HPGDALDH1A1POLBHRH2L3MBTL1
SCHEMBL7975009 1.00 HPGD (0.56) HPGDALDH1A1POLBHRH2L3MBTL1
SCHEMBL7972671 0.89 TACR1 (0.51) HPGDALDH1A1L3MBTL1KMT2AHTT
SCHEMBL14040795 0.86 TACR1 (0.47) HPGDALDH1A1KMT2AHTTSMN1; SMN2
SCHEMBL7774834 0.79 HPGD (0.41) HPGDALDH1A1POLBL3MBTL1KMT2A
SCHEMBL7974337 0.78 L3MBTL1 (0.58) HPGDL3MBTL1KMT2ARAB9A
SCHEMBL7774842 0.77 LMNA (0.46) ALDH1A1POLBL3MBTL1KMT2ARAB9A
SCHEMBL4382548 0.77 NPC1 (0.47) ALDH1A1RAB9ANPC1SMN1; SMN2HRH4
SCHEMBL7973146 0.77 LMNA (0.42) HPGDALDH1A1L3MBTL1KMT2AHTT
SCHEMBL21820178 0.76 ALDH1A1 (0.37) HPGDALDH1A1POLBL3MBTL1KMT2A

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
US-5708171-A HISTAMINE H3-RECEPTOR ANTAGONIST INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (FR) 1998-01-13 US claimed
US-RE37303-E1 Imidazole compounds and their therapeutic applications INSTITUT NATIONAL DEL LA SANTE ET DE LA RECHERCHE MEDICALE (FR) 2001-07-31 US disclosed
US-5708171-A HISTAMINE H3-RECEPTOR ANTAGONIST INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (FR) 1998-01-13 US disclosed
US-5559113-A ANTAGONISTS TO HISTAMINE H3 RECEPTORS, SEDATIVES, ANTICONVULSANTS, ANTIULCER AGENTS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE 1996-09-24 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