SCHEMBL7977246

SCHEMBL7977246

FC(F)(F)c1ccc(OCCc2cn(C(c3ccccc3)(c3ccccc3)c3ccccc3)cn2)cc1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 4/20 0.43
NOS1 P29475 4/20 0.42
LTA4H P09960 2/20 0.40
DRD2 P14416 3/20 0.39
DRD1 P21728 1/20 0.39
DRD3 P35462 1/20 0.39
MCL1 Q07820 1/20 0.38
NSD2 O96028 1/20 0.37
NSD3 Q9BZ95 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL7972712 0.94 NOS1 (0.43) SIRT2NOS1LTA4HDRD2DRD1
SCHEMBL7974401 0.85 SIRT2 (0.43) SIRT2DRD2DRD1DRD3L3MBTL1
SCHEMBL10815629 0.79 SIRT2 (0.46) SIRT2
SCHEMBL4379824 0.78 SIRT2 (0.43) SIRT2
SCHEMBL7971428 0.78 MEN1 (0.43) SIRT2
SCHEMBL5792879 0.77 SIRT2 (0.47) SIRT2
SCHEMBL4379706 0.76 SIRT2 (0.42) SIRT2DRD2MCL1
SCHEMBL6674214 0.76 KCNH2 (0.46) SIRT2
SCHEMBL8794940 0.74 SIRT2 (0.49) SIRT2DRD2DRD1DRD3L3MBTL1
SCHEMBL7159342 0.74 SIRT2 (0.49) SIRT2DRD2DRD1DRD3L3MBTL1

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-RE37303-E1 Imidazole compounds and their therapeutic applications INSTITUT NATIONAL DEL LA SANTE ET DE LA RECHERCHE MEDICALE (FR) 2001-07-31 US disclosed
EP-0597088-B1 NOVEL IMIDAZOLE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC APPLICATIONS INST NAT SANTE RECH MED (FR) 2000-12-06 EP 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