SCHEMBL11325815

SCHEMBL11325815

CCCCCCCCCCCCCCCCC(O)C(O)(CCCCCCCCCCCCCCCC)COP(=O)(O)O

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 4/20 0.47
SGPL1 O95470 4/20 0.47
LPAR3 Q9UBY5 3/20 0.45
LPAR1 Q92633 2/20 0.45
LPAR2 Q9HBW0 2/20 0.45
FDPS P14324 7/20 0.44
GGPS1 O95749 3/20 0.44

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
Dimethylamine SCHEMBL10482623 0.81 SMPD1 (0.46) SMPD1SGPL1LPAR3LPAR1LPAR2
SCHEMBL12766767 0.81 SGPL1 (0.48) SMPD1SGPL1LPAR3LPAR1LPAR2
SCHEMBL15892988 0.80 SGPL1 (0.50) SMPD1SGPL1LPAR3LPAR1LPAR2
SCHEMBL21192736 0.79 GPR84 (0.42) FDPSGGPS1
SCHEMBL28903645 0.79 GPR84 (0.42) FDPSGGPS1
SCHEMBL10594234 0.78 LPAR5 (0.50) SMPD1SGPL1LPAR3LPAR1LPAR2
SCHEMBL2596151 0.78 LPAR5 (0.50) SMPD1SGPL1LPAR3LPAR1LPAR2
SCHEMBL93994 0.74 TSHR (0.44)
SCHEMBL9113451 0.74 SGPL1 (0.45) SMPD1SGPL1LPAR3LPAR1LPAR2
SCHEMBL1147850 0.74 LMNA (0.42) FDPSGGPS1

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
US-4291024-A ANTICANCER AGENTS UNIVERSITY OF RHODE ISLAND 1981-09-22 US disclosed