SCHEMBL24425977

SCHEMBL24425977

B[C@H]1C[C@@H](O)[C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)OCCCCCCC)O1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 3/20 0.39
LPAR1 Q92633 2/20 0.39
LPAR2 Q9HBW0 2/20 0.39
ADK P55263 5/20 0.38
P2RY2 P41231 3/20 0.37
POLA1 P09884 1/20 0.37
P2RY12 Q9H244 2/20 0.37
AKT1 P31749 2/20 0.35
PLCG2 P16885 1/20 0.35
PIK3R1 P27986 1/20 0.35
AKT2 P31751 1/20 0.35
PIK3CA P42336 1/20 0.35
AKT3 Q9Y243 1/20 0.35
GAB1 Q13480 1/20 0.35
TRPM2 O94759 1/20 0.35
P2RY6 Q15077 1/20 0.35
P2RY14 Q15391 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
SCHEMBL21527541 1.00 LPAR3 (0.39) LPAR3LPAR1LPAR2ADKP2RY2
SCHEMBL16270912 0.82 P2RY2 (0.41) P2RY2POLA1
SCHEMBL24913571 0.82 P2RY2 (0.41) P2RY2POLA1
SCHEMBL23424112 0.82 P2RY2 (0.41) P2RY2POLA1
SCHEMBL10239207 0.82 P2RY2 (0.41) P2RY2POLA1
SCHEMBL887524 0.80 POLB (0.35) P2RY2P2RY6
SCHEMBL14129222 0.80 POLB (0.35) P2RY2P2RY6
SCHEMBL19412507 0.80 PLCD1 (0.36) LPAR1LPAR2P2RY2TRPM2P2RY14
SCHEMBL13769928 0.79 P2RY2 (0.37) P2RY2POLA1TRPM2P2RY6
SCHEMBL12413504 0.77 P2RY2 (0.34) P2RY2TRPM2P2RY6

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-3998471-A1 METHOD OF DETERMINING THE SEQUENCE OF A NUCLEIC ACID USING TIME RESOLVED LUMINESCENCE Quantum-si Incorporated (US) 2022-05-18 EP disclosed