SCHEMBL6913715

SCHEMBL6913715

CCCCCCCCCC(Cl)CC(=O)C(C)(C)C.CCCCCCCCCC(F)CC(=O)C(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.41
GPR84 Q9NQS5 7/20 0.37
CA2 P00918 1/20 0.37
FAAH O00519 7/20 0.35
CES1 P23141 5/20 0.35
CES2 O00748 3/20 0.35
MEN1 O00255 1/20 0.35
CYP1A2 P05177 1/20 0.35
KMT2A Q03164 1/20 0.35
HSD17B10 Q99714 1/20 0.35
FFAR1 O14842 1/20 0.35

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
SCHEMBL5196418 0.91 GPR84 (0.43) MAPTGPR84CA2FAAHCES1
SCHEMBL5196923 0.91 MAPT (0.48) MAPTGPR84CA2FAAHCES1
SCHEMBL5197793 0.91 GPR84 (0.43) MAPTGPR84CA2FAAHCES1
SCHEMBL5194151 0.91 MAPT (0.48) MAPTGPR84CA2FAAHCES1
SCHEMBL5197299 0.91 MAPT (0.48) MAPTGPR84CA2FAAHCES1
SCHEMBL5196370 0.91 MAPT (0.48) MAPTGPR84CA2FAAHCES1
SCHEMBL5195699 0.91 GPR84 (0.43) MAPTGPR84CA2FAAHCES1
SCHEMBL5194178 0.91 GPR84 (0.43) MAPTGPR84CA2FAAHCES1
SCHEMBL5195926 0.89 MAPT (0.46) MAPTGPR84CA2FAAHCES1
SCHEMBL5194608 0.89 GPR84 (0.40) MAPTGPR84CA2FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1403260-A2 Optically active epoxy compounds and processes for their production Tosoh Corporation (JP) 2004-03-31 EP disclosed