SCHEMBL19924374

SCHEMBL19924374

C#CCCCCOP(=O)(O)O

nearest known ligand 0.63

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ LPAR3 Q9UBY5 9/20 0.52
▸ LPAR2 Q9HBW0 6/20 0.52
▸ LPAR1 Q92633 4/20 0.52
▸ CYP2D6 P10635 2/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ CSNK2A2 P19784 1/20 0.35
▸ CSNK2B P67870 1/20 0.35
▸ CSNK2A1 P68400 1/20 0.35
▸ CSNK2A3 Q8NEV1 1/20 0.35
▸ USP2 O75604 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL18604595 0.93 LPAR3 (0.48) LPAR3LPAR2LPAR1CYP2D6CYP1A2
SCHEMBL26334857 0.87 CYP2D6 (0.39) LPAR3LPAR2LPAR1CYP2D6CYP1A2
SCHEMBL26334850 0.85 CYP2D6 (0.42) LPAR3LPAR2LPAR1CYP2D6CYP1A2
SCHEMBL26334858 0.85 CYP2D6 (0.42) LPAR3LPAR2LPAR1CYP2D6CYP1A2
SCHEMBL26334849 0.85 CYP2D6 (0.42) LPAR3LPAR2LPAR1CYP2D6CYP1A2
SCHEMBL14816068 0.84 BTN3A1 (0.44) LPAR3LPAR2LPAR1CYP2D6CYP1A2
SCHEMBL28583404 0.84 — —
SCHEMBL12091539 0.83 SAT1 (0.44) LPAR3LPAR2LPAR1CYP2D6CYP1A2
SCHEMBL1574125 0.81 LPAR3 (0.71) LPAR3LPAR2LPAR1CSNK2A2CSNK2B
SCHEMBL17327639 0.80 LPAR3 (0.37) LPAR3LPAR2LPAR1CYP2D6CYP1A2

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-20230257745-A1 Circular siRNAs BANK OF AMERICA, N.A. 2023-08-17 — — US disclosed
WO-2018037096-A1 TAGGED NUCLEOTIDES USEFUL FOR NANOPORE DETECTION F. HOFFMANN-LA ROCHE AG (CH) 2018-03-01 — — WO disclosed
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