SCHEMBL31631906

SCHEMBL31631906

C[Si](C)(C)CCOCn1c(S(C)(=O)=O)cnc1C(O)c1ccc(F)c(Cl)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ F2RL1 P55085 1/20 0.37
▸ GRIN2B Q13224 2/20 0.33
▸ GRIN1 Q05586 1/20 0.33
▸ PTGS2 P35354 5/20 0.33
▸ ALOX5AP P20292 2/20 0.32
▸ FEN1 P39748 2/20 0.32
▸ PTGS1 P23219 1/20 0.31
▸ TP53 P04637 1/20 0.31
▸ GRM2 Q14416 1/20 0.31
▸ S1PR1 P21453 1/20 0.31
▸ S1PR3 Q99500 1/20 0.31
▸ MAPK1 P28482 1/20 0.30
▸ CYP3A4 P08684 1/20 0.30
▸ CYP2D6 P10635 1/20 0.30
▸ SLC6A2 P23975 1/20 0.30
▸ SLC6A4 P31645 1/20 0.30
▸ SLC6A3 Q01959 1/20 0.30
▸ KCNH2 Q12809 1/20 0.30
▸ NPC1 O15118 1/20 0.30
▸ F11 P03951 1/20 0.30

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
SCHEMBL31631810 0.86 F2RL1 (0.37) F2RL1GRIN2BGRIN1GRM2CYP3A4
SCHEMBL31631772 0.85 F2RL1 (0.37) F2RL1GRIN2BGRIN1GRM2CYP3A4
SCHEMBL31631865 0.83 F2RL1 (0.35) F2RL1PTGS2PTGS1TP53S1PR1
SCHEMBL31631744 0.83 F2RL1 (0.35) F2RL1PTGS2PTGS1TP53S1PR1
SCHEMBL31631840 0.83 HDAC6 (0.32) GRIN2BGRIN1HDAC6MAPT
SCHEMBL31629499 0.80 F2RL1 (0.35) F2RL1PTGS2PTGS1CYP3A4CYP2D6
SCHEMBL31629501 0.80 F2RL1 (0.35) F2RL1PTGS2PTGS1CYP3A4CYP2D6
SCHEMBL31631896 0.79 NPC1 (0.37) GRIN2BGRIN1PTGS2ALOX5APFEN1
SCHEMBL31629313 0.79 ALOX5AP (0.33) F2RL1GRIN2BGRIN1PTGS2ALOX5AP
SCHEMBL31631830 0.77 F2RL1 (0.35) F2RL1CYP3A4CYP2D6SLC6A2SLC6A4

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
WO-2025125665-A1 FURTHER SUBSTITUTED IMIDAZOLES AS INHIBITORS OF NAV1.8 Grünenthal GmbH (DE) 2025-06-19 — — WO disclosed
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