SCHEMBL29068451

SCHEMBL29068451

CCCCCC(CCC)(CCCCC)OP(=O)(O)O

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 5/20 0.61
FDPS P14324 11/20 0.48
GGPS1 O95749 7/20 0.48
LPAR1 Q92633 3/20 0.46
LPAR3 Q9UBY5 3/20 0.46
LPAR2 Q9HBW0 1/20 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
SCHEMBL9660278 0.98 SMPD1 (0.65) SMPD1FDPSGGPS1LPAR1LPAR3
SCHEMBL7867852 0.98 SMPD1 (0.65) SMPD1FDPSGGPS1LPAR1LPAR3
SCHEMBL1665182 0.98 SMPD1 (0.65) SMPD1FDPSGGPS1LPAR1LPAR3
SCHEMBL9615788 0.98 SMPD1 (0.65) SMPD1FDPSGGPS1LPAR1LPAR3
SCHEMBL25174113 0.94 SMPD1 (0.69) SMPD1FDPSGGPS1LPAR1LPAR3
SCHEMBL11841083 0.94 SMPD1 (0.69) SMPD1FDPSGGPS1LPAR1LPAR3
SCHEMBL5908931 0.94 SMPD1 (0.53) SMPD1FDPSGGPS1LPAR1LPAR3
SCHEMBL8567245 0.94 SMPD1 (0.69) SMPD1FDPSGGPS1LPAR1LPAR3
SCHEMBL9659055 0.94 SMPD1 (0.69) SMPD1FDPSGGPS1LPAR1LPAR3
SCHEMBL1761280 0.94 SMPD1 (0.63) SMPD1FDPSGGPS1LPAR1LPAR3

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
CN-116745025-A membrane for water filtration 水通道蛋白有限公司 2023-09-12 CN disclosed