SCHEMBL9757466

SCHEMBL9757466

CCCCCCCCC(CCCCCC)(CCCCCC)OP=O

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 5/20 0.42
GGPS1 O95749 6/20 0.39
FDPS P14324 9/20 0.38
CES2 O00748 1/20 0.36
LPAR1 Q92633 1/20 0.36
LPAR3 Q9UBY5 1/20 0.36
TSHR P16473 1/20 0.36
THRB P10828 1/20 0.36

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
SCHEMBL14967004 0.80
SCHEMBL16208461 0.80 SMPD1 (0.41) SMPD1GGPS1FDPSCES2LPAR1
SCHEMBL9284211 0.78 SMPD1 (0.35) SMPD1GGPS1FDPSCES2LPAR1
SCHEMBL28541152 0.77 SMPD1 (0.39) SMPD1GGPS1FDPSCES2LPAR1
SCHEMBL4087826 0.72 SMPD1 (0.36) SMPD1GGPS1FDPSCES2LPAR1
SCHEMBL28571235 0.72 TSHR (0.47) SMPD1GGPS1FDPSCES2LPAR1
SCHEMBL30381193 0.72 TSHR (0.47) SMPD1GGPS1FDPSCES2LPAR1
SCHEMBL7189663 0.72 TSHR (0.47) SMPD1GGPS1FDPSCES2LPAR1
SCHEMBL8470352 0.72 TSHR (0.47) SMPD1GGPS1FDPSCES2LPAR1
SCHEMBL14967020 0.71

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-0239501-B1 PROCESS FOR SEPARATING IRON FROM AN ORGANIC SOLUTION CONTAINING URANIUM COMPAGNIE GENERALE DES MATIERES NUCLEAIRES (COGEMA) (FR) 1991-07-24 EP claimed
US-5017344-A Phosphine oxide, phosphate COMPAGNIE GENERALE DES MATIERES NUCLEAIRES (COGEMA) (FR) 1991-05-21 US disclosed