SCHEMBL4383603

SCHEMBL4383603

COc1ccc(Oc2ccc(OC)cc2CCCc2c[nH]cn2)c(CCCc2c[nH]cn2)c1

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ADRA1A P35348 1/20 0.42
TAAR1 Q96RJ0 1/20 0.42
MTNR1B P49286 8/20 0.40
MTNR1A P48039 8/20 0.40
AOC3 Q16853 1/20 0.39
IDO1 P14902 1/20 0.36

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
SCHEMBL4383597 0.90 ADRA1A (0.42) ADRA1ATAAR1MTNR1BMTNR1AAOC3
SCHEMBL8795928 0.84 ADRA1A (0.41) ADRA1ATAAR1MTNR1BMTNR1AAOC3
SCHEMBL4386727 0.81 PPARG (0.32)
SCHEMBL4377941 0.79
SCHEMBL4391797 0.77 GABRA1 (0.32)
SCHEMBL7987297 0.76 HRH3 (0.54)
SCHEMBL4386723 0.75 KDM4E (0.32)
SCHEMBL4380953 0.75 HRH3 (0.35)
SCHEMBL4390054 0.73 L3MBTL1 (0.39)
SCHEMBL2104741 0.71 CHRM2 (0.40) ADRA1ATAAR1MTNR1B

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
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 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