SCHEMBL26617612

SCHEMBL26617612

COC(=O)c1cccc(NC(=O)c2nc3ccccc3nc2N2CCCC(F)(F)CC2)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.66
▸ TP53 P04637 5/20 0.54
▸ SCN10A Q9Y5Y9 5/20 0.53
▸ LMNA P02545 3/20 0.52
▸ THRB P10828 1/20 0.52
▸ RXFP1 Q9HBX9 1/20 0.48
▸ RAB9A P51151 1/20 0.46
▸ TSHR P16473 2/20 0.45
▸ KDM4E B2RXH2 1/20 0.45
▸ POLB P06746 1/20 0.45
▸ HSD17B10 Q99714 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ HIF1A Q16665 1/20 0.44
▸ ROCK2 O75116 2/20 0.44
▸ PRKACA P17612 1/20 0.44
▸ PRKACG P22612 1/20 0.44
▸ PRKACB P22694 1/20 0.44
▸ LIMK1 P53667 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
SCHEMBL30681914 1.00 MAPT (0.66) MAPTTP53SCN10ALMNATHRB
SCHEMBL31345644 0.89 MAPT (0.65) MAPTTP53SCN10ALMNATHRB
SCHEMBL26617713 0.89 MAPT (0.65) MAPTTP53SCN10ALMNATHRB
SCHEMBL30682078 0.88 SCN10A (0.54) MAPTTP53SCN10ALMNA
SCHEMBL26617535 0.88 SCN10A (0.54) MAPTTP53SCN10ALMNA
SCHEMBL26617986 0.84 SCN10A (0.65) MAPTTP53SCN10ALMNATHRB
SCHEMBL26617522 0.84 MAPT (0.47) MAPTTP53SCN10ALMNATHRB
SCHEMBL31105531 0.83 SCN10A (0.63) MAPTTP53SCN10ALMNATHRB
SCHEMBL26617573 0.83 SCN10A (0.64) MAPTTP53SCN10ALMNATHRB
SCHEMBL26617761 0.82 SCN10A (0.79) MAPTSCN10A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4514789-A1 <SUP2/>? <SUB2/>?V?BICYCLIC HETEROCYCLIC AMIDE INHIBITORS OF NA1.8 FOR THE TREATMENT OF PAIN SiteOne Therapeutics, Inc. (US) 2025-03-05 — — EP disclosed
WO-2023211990-A1 BICYCLIC HETEROCYCLIC AMIDE INHIBITORS OF NA V1.8 FOR THE TREATMENT OF PAIN SITEONE THERAPEUTICS, INC. (US) 2023-11-02 — — WO disclosed
WO-2023211990-A1 BICYCLIC HETEROCYCLIC AMIDE INHIBITORS OF NA V1.8 FOR THE TREATMENT OF PAIN SITEONE THERAPEUTICS, INC. (US) 2023-11-02 — — WO disclosed
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