SCHEMBL8106539

SCHEMBL8106539

NC(=O)N(OCCCc1c[nH]cn1)C1CCCCC1

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PAX8 Q06710 1/20 0.34
HRH3 Q9Y5N1 5/20 0.31
HRH4 Q9H3N8 3/20 0.31

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
SCHEMBL8104961 0.81 ALOX5 (0.35) HRH3HRH4
SCHEMBL8105711 0.78 ALOX5 (0.32) HRH3HRH4
SCHEMBL7977480 0.72 EPHX1 (0.51) HRH3HRH4
SCHEMBL8105543 0.71 LMNA (0.34) HRH3
SCHEMBL480739 0.71 LMNA (0.46) HRH3HRH4
SCHEMBL7971425 0.71 HRH3 (0.50) HRH3HRH4
SCHEMBL7988521 0.70 HRH3 (0.56) HRH3HRH4
SCHEMBL8106470 0.70 KCNH2 (0.34)
SCHEMBL8105730 0.70 NR3C2 (0.30)
SCHEMBL9436160 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0597088-B1 NOVEL IMIDAZOLE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC APPLICATIONS INST NAT SANTE RECH MED (FR) 2000-12-06 EP claimed
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 claimed
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 claimed