SCHEMBL8104614

SCHEMBL8104614

NC(=O)NOCCC(CCCc1ccccc1)c1c[nH]cn1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.39
GRIK1 P39086 1/20 0.35
FAAH O00519 2/20 0.35
LTA4H P09960 1/20 0.35
NR3C2 P08235 1/20 0.34
EPHX2 P34913 1/20 0.34
MMP2 P08253 1/20 0.33
BMP1 P13497 1/20 0.33
FFAR1 O14842 1/20 0.33
NPC1 O15118 1/20 0.33
RECQL P46063 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
S1PR1 P21453 1/20 0.33
SIRT2 Q8IXJ6 1/20 0.33

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
SCHEMBL8115904 0.93 NR3C2 (0.35) LMNALTA4HNR3C2MMP2SMN1; SMN2
SCHEMBL8120942 0.88 MAPT (0.34) NR3C2RECQLS1PR1
SCHEMBL8114715 0.83 NR3C2 (0.36) LMNANR3C2MMP2SMN1; SMN2
SCHEMBL8104990 0.82 HRH3 (0.36)
SCHEMBL8105539 0.80 NR3C2 (0.37) LMNANR3C2EPHX2RAB9ASMN1; SMN2
SCHEMBL8106289 0.79 FAAH (0.36) FAAHS1PR1
SCHEMBL8114366 0.78 RAD52 (0.30)
SCHEMBL8115322 0.77 NR3C2 (0.33) NR3C2
SCHEMBL8115062 0.77 CYP2C9 (0.35) MMP2RAB9A
SCHEMBL8120253 0.76 ALDH1A1 (0.32) NPC1RAB9A

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 6 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
EP-0597088-B1 NOVEL IMIDAZOLE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC APPLICATIONS INST NAT SANTE RECH MED (FR) 2000-12-06 EP disclosed
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 disclosed
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 disclosed