SCHEMBL4382488

SCHEMBL4382488

Fc1ccc(C(c2ccccc2)C(CCOCCC(c2c[nH]cn2)C(c2ccccc2)c2ccc(F)cc2)c2c[nH]cn2)cc1

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 7/20 0.37
SLC6A4 P31645 3/20 0.34
SLC6A3 Q01959 3/20 0.34
SLC6A2 P23975 1/20 0.33

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
SCHEMBL8114777 0.81 ESR1 (0.33) SLC6A3SLC6A2
SCHEMBL4387280 0.77 CYP19A1 (0.31) CYP19A1
SCHEMBL9120738 0.72 CYP19A1 (0.58) CYP19A1SLC6A4SLC6A3SLC6A2
SCHEMBL4382483 0.71 CYP19A1 (0.40) CYP19A1SLC6A4SLC6A3
SCHEMBL8115694 0.71 SHBG (0.37)
SCHEMBL9728037 0.70 CYP19A1 (0.55) CYP19A1
SCHEMBL9121148 0.70 CYP19A1 (0.60) CYP19A1SLC6A4SLC6A3SLC6A2
SCHEMBL9124189 0.69 CYP19A1 (0.55) CYP19A1SLC6A4SLC6A3SLC6A2
SCHEMBL4381403 0.69 ESR1 (0.34) CYP19A1
SCHEMBL9123280 0.69 CYP19A1 (0.56) CYP19A1SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0760811-B1 IMIDAZOLE DERIVATIVES AS HISTAMINE RECEPTOR H3 MODULATORS INST NAT SANTE RECH MED (FR) 2009-11-18 EP claimed
EP-0760811-B1 IMIDAZOLE DERIVATIVES AS HISTAMINE RECEPTOR H3 MODULATORS INST NAT SANTE RECH MED (FR) 2009-11-18 EP disclosed
EP-0760811-A1 IMIDAZOLE DERIVATIVES AS HISTAMINE RECEPTOR H 3? (ANT)AGONISTS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 1997-03-12 EP disclosed
WO-1996029315-A2 IMIDAZOLE DERIVATIVES AS HISTAMINE RECEPTOR H3 (ANT)AGONISTS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (FR) 1996-09-26 WO disclosed