SCHEMBL11045407

SCHEMBL11045407

CCCCCC(CCCC)(CCCCC)S(C)(=O)=O

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FDPS P14324 11/20 0.37
GGPS1 O95749 7/20 0.37
FAAH O00519 2/20 0.36
CES2 O00748 1/20 0.34
LPAR1 Q92633 1/20 0.34
LPAR3 Q9UBY5 1/20 0.34
SMPD1 P17405 1/20 0.34

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
SCHEMBL10779656 0.76 GGPS1 (0.43) FDPSGGPS1CES2LPAR1LPAR3
SCHEMBL11381918 0.75 FDPS (0.41) FDPSGGPS1CES2LPAR1LPAR3
SCHEMBL9526924 0.75 CA2 (0.45) FDPSSMPD1
SCHEMBL23542126 0.73 CA1 (0.40) FDPSGGPS1FAAH
SCHEMBL22877813 0.73 CA1 (0.40) FDPSGGPS1FAAH
SCHEMBL28628026 0.73 GGPS1 (0.45) FDPSGGPS1CES2LPAR1LPAR3
SCHEMBL24241700 0.73 CA1 (0.40) FDPSGGPS1FAAH
SCHEMBL22722136 0.73 CA1 (0.40) FDPSGGPS1FAAH
SCHEMBL5573620 0.73 FDPS (0.43) FDPSGGPS1SMPD1
SCHEMBL12669288 0.73 GGPS1 (0.40) FDPSGGPS1FAAHCES2LPAR1

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
US-4494989-A PRESSURE SENSITIVE CARBONLESS DUPLICATING OR THERMAL MARKING SYSTEMS THE HILTON-DAVIS CHEMICAL CO. (US) 1985-01-22 US disclosed
US-4257954-A INDOLYL-PHENYLSULFONYL-PHENYL METHANE STERLING DRUG INC. (US) 1981-03-24 US disclosed