SCHEMBL5201005

SCHEMBL5201005

C[Si](C)(C)CCOCn1c(N2CCNCC2)nc(-c2cc(F)c(F)c(F)c2)c1-c1cc(F)c(F)c(F)c1.C[Si](C)(C)CCOCn1c(N2CCNCC2)nc(Br)c1Br

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 1/20 0.34
SOS1 Q07889 8/20 0.32
KDM1A O60341 1/20 0.31
PIM1 P11309 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
SCHEMBL4853070 0.93 HTR2C (0.38) HTR2CSOS1KDM1A
SCHEMBL4842921 0.90 HTR2C (0.38) HTR2CSOS1KDM1APIM1
SCHEMBL4841841 0.84 SOS1 (0.42) HTR2CSOS1KDM1APIM1
SCHEMBL68342 0.82 PIM1 (0.41) HTR2CPIM1
SCHEMBL4841972 0.74 SOS1 (0.44) HTR2CSOS1KDM1APIM1
SCHEMBL68028 0.70 ACVR1 (0.42)
SCHEMBL4847436 0.65 HTR2C (0.36) HTR2CSOS1PIM1
SCHEMBL68112 0.65 DGAT1 (0.41)
SCHEMBL5213310 0.63 DGAT1 (0.37)
SCHEMBL23781131 0.63 DGAT1 (0.39)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1802605-A1 IMIDAZOLE DERIVATIVES AS VANILLOID RECEPTOR LIGANDS Amgen, Inc (US) 2007-07-04 EP disclosed
WO-2006044527-A1 IMIDAZOLE DERIVATIVES AS VANILLOID RECEPTOR LIGANDS AMGEN INC. (US) 2006-04-27 WO disclosed