SCHEMBL4378571

SCHEMBL4378571

FC(F)(F)c1ccc(CCCC(CCOCCC(CCCc2ccc(C(F)(F)F)cc2)c2c[nH]cn2)c2c[nH]cn2)cc1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FDFT1 P37268 2/20 0.38
GAA P10253 1/20 0.34
TAAR1 Q96RJ0 1/20 0.34
PTGES O14684 1/20 0.33
ALOX5 P09917 1/20 0.33
PPARG P37231 1/20 0.33
MAOB P27338 2/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
HMOX1 P09601 1/20 0.32
DAO P14920 1/20 0.32
NAAA Q02083 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL8114781 0.86 CYP19A1 (0.39) GAAMEN1KMT2A
SCHEMBL8113194 0.86 TAAR1 (0.39) FDFT1GAATAAR1HDAC1HDAC8
SCHEMBL650315 0.84 SLC6A2 (0.39) GAAPPARG
SCHEMBL8115135 0.84 HMOX1 (0.32) HMOX1
SCHEMBL8104990 0.84 HRH3 (0.36) MAOBMEN1KMT2A
SCHEMBL8115697 0.81 DAO (0.31) DAO
SCHEMBL8106289 0.80 FAAH (0.36) NAAAMEN1KMT2A
SCHEMBL8114453 0.71 NR3C2 (0.36) PPARGMAOBHDAC1HDAC8
SCHEMBL4381064 0.71 S1PR4 (0.36) MAOBDAO
SCHEMBL4384991 0.70 BMP1 (0.33)

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-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 claimed
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
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