SCHEMBL8106536

SCHEMBL8106536

NC(=O)NOCCC(c1c[nH]cn1)C1CCCCC1

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
MITF O75030 1/20 0.32
HRH3 Q9Y5N1 2/20 0.31
PNP P00491 1/20 0.31
ALDH1A1 P00352 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL9436007 0.82 METAP2 (0.32)
SCHEMBL8105708 0.78 CNR2 (0.32)
SCHEMBL4378054 0.74
SCHEMBL8105539 0.73 NR3C2 (0.37) ALDH1A1NPSR1
SCHEMBL8106469 0.71 LMNA (0.37) KMT2AALDH1A1
SCHEMBL8105433 0.71 GAA (0.30)
SCHEMBL8105725 0.71 EPHX2 (0.35) MEN1KMT2AALDH1A1
SCHEMBL9436157 0.71 PMP22 (0.37) MEN1KMT2AHRH3
SCHEMBL8115859 0.71 BLM (0.37) HRH3NPSR1
SCHEMBL8120253 0.70 ALDH1A1 (0.32) ALDH1A1

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