SCHEMBL4382490

SCHEMBL4382490

Fc1ccc(-c2ccccc2CC(CCc2c[nH]cn2)OC(CCc2c[nH]cn2)Cc2ccccc2-c2ccc(F)cc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.36
FFAR4 Q5NUL3 1/20 0.36
MC4R P32245 5/20 0.32
MLNR O43193 2/20 0.32
CYP3A4 P08684 1/20 0.32
KMT2A Q03164 1/20 0.31
BRS3 P32247 1/20 0.31
NR4A2 P43354 1/20 0.31
QPCT Q16769 1/20 0.31
CYP19A1 P11511 1/20 0.31
ALDH1A1 P00352 2/20 0.30
KCNA5 P22460 1/20 0.30
KCNH2 Q12809 1/20 0.30
NPC1 O15118 1/20 0.30
MAPT P10636 1/20 0.30
MAOB P27338 1/20 0.30
CASP3 P42574 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
SENP8 Q96LD8 1/20 0.30

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
SCHEMBL7987765 0.78 FFAR1 (0.40) FFAR1FFAR4MC4RQPCT
SCHEMBL8104752 0.75 CNR1 (0.36) SMN1; SMN2LMNA
SCHEMBL8114784 0.72 CYP19A1 (0.41) CYP19A1
SCHEMBL9728037 0.71 CYP19A1 (0.55) KMT2ACYP19A1ALDH1A1MAPTLMNA
SCHEMBL4382430 0.69 CTSK (0.33)
SCHEMBL9728051 0.69 CYP19A1 (0.51) KMT2ACYP19A1
SCHEMBL4382483 0.69 CYP19A1 (0.40) KMT2ACYP19A1
SCHEMBL2103787 0.68 DPP4 (0.43) KMT2AALDH1A1KCNA5KCNH2PTGDR2
SCHEMBL9122689 0.67 CYP19A1 (0.56) MC4RMLNRCYP3A4KMT2ACYP19A1
SCHEMBL9190554 0.67 CYP19A1 (0.59) CYP3A4KMT2ACYP19A1ALDH1A1KCNH2

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