SCHEMBL2173048

SCHEMBL2173048

COCCCCC1C=CC=CC1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 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
SCHEMBL11960340 0.86 SIGMAR1 (0.31) SIGMAR1
SCHEMBL30695179 0.79 ALDH1A1 (0.39) SIGMAR1
SCHEMBL18951468 0.78 SIGMAR1 (0.35) SIGMAR1
SCHEMBL28211897 0.76 MAPK1 (0.32)
SCHEMBL16287326 0.76
SCHEMBL18295756 0.75 SIGMAR1 (0.33) SIGMAR1
SCHEMBL16845264 0.75 SIGMAR1 (0.31) SIGMAR1
SCHEMBL15128022 0.74
SCHEMBL16288149 0.74 ALDH1A1 (0.35)
SCHEMBL14074643 0.74

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-2346334-A1 OXAZOLOBENZIMIDAZOLE DERIVATIVES Merck Sharp & Dohme Corp. (US) 2011-07-27 EP disclosed
WO-2010036544-A1 OXAZOLOBENZIMIDAZOLE DERIVATIVES MERCK SHARP & DOHME CORP. (US) 2010-04-01 WO disclosed