SCHEMBL18004252

SCHEMBL18004252

N#Cc1[nH]nnc1-c1cc(Cc2ccc(C(F)(F)F)cc2)cc(OC(F)(F)F)c1

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ DAO P14920 1/20 0.35
▸ TRPA1 O75762 3/20 0.35
▸ SCN5A Q14524 1/20 0.34
▸ SCN9A Q15858 1/20 0.34
▸ USP7 Q93009 1/20 0.34
▸ FFAR2 O15552 1/20 0.34
▸ CHRM5 P08912 1/20 0.31
▸ LTA4H P09960 1/20 0.31
▸ KDM1A O60341 1/20 0.31
▸ MAOB P27338 1/20 0.31
▸ FFAR4 Q5NUL3 1/20 0.31
▸ CTSS P25774 1/20 0.30
▸ CTSK P43235 1/20 0.30
▸ SMO Q99835 1/20 0.30
▸ CNR1 P21554 1/20 0.30
▸ KIF11 P52732 1/20 0.30
▸ PGR P06401 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
SCHEMBL16399599 0.90 TRPA1 (0.35) TRPA1SCN5ASCN9AUSP7FFAR4
SCHEMBL18004037 0.89 USP7 (0.37) TRPA1SCN5ASCN9AUSP7FFAR4
SCHEMBL18004162 0.89 USP7 (0.36) DAOTRPA1SCN5ASCN9AUSP7
SCHEMBL18004258 0.88 TRPA1 (0.32) TRPA1SCN5ASCN9AUSP7
SCHEMBL18004031 0.88 RXRA (0.38) DAOFFAR2KDM1AMAOBCTSS
SCHEMBL18004067 0.87 TRPA1 (0.39) DAOTRPA1SCN5ASCN9AUSP7
SCHEMBL18004214 0.86 MAOB (0.38) DAOTRPA1SCN5ASCN9AMAOB
SCHEMBL18003935 0.84 CNR1 (0.35) DAOFFAR2LTA4HCTSSCTSK
SCHEMBL18003986 0.84 IDH1 (0.36) DAOFFAR2LTA4HCTSSCTSK
SCHEMBL18004420 0.83 TRPA1 (0.37) TRPA1SCN5ASCN9AKDM1AMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4219477-A1 CYANOTRIAZOLE COMPOUNDS Otsuka Pharmaceutical Co., Ltd. (JP) 2023-08-02 — — EP disclosed
US-10626095-B2 Cyanotriazole compounds OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2020-04-21 — — US disclosed
US-20160229816-A1 CYANOTRIAZOLE COMPOUNDS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2016-08-11 — — US disclosed
US-20160229816-A1 CYANOTRIAZOLE COMPOUNDS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2016-08-11 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10626095-B2 Cyanotriazole compounds CS, PC, ACAT1 DAO 732/4885TRPA1 3643/4885SCN5A 1521/4885
US-20160229816-A1 CYANOTRIAZOLE COMPOUNDS CS, PC, ACAT1 DAO 732/4885TRPA1 3643/4885SCN5A 1521/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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