SCHEMBL21751245

SCHEMBL21751245

FC(F)(F)Oc1cccc(CSc2nccs2)c1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CTSA P10619 1/20 0.46
CETP P11597 2/20 0.42
POLB P06746 1/20 0.41
PTPN1 P18031 1/20 0.41
KCNN4 O15554 4/20 0.41
EPHX1 P07099 1/20 0.41
FEN1 P39748 1/20 0.39
ROCK1 Q13464 2/20 0.39
ROCK2 O75116 1/20 0.39
CHRM2 P08172 1/20 0.39
CHRM1 P11229 1/20 0.39
CHRM3 P20309 1/20 0.39
KDM5A P29375 1/20 0.38
KDM4C Q9H3R0 1/20 0.38
KDM5B Q9UGL1 1/20 0.38
DAO P14920 1/20 0.38
DCUN1D1 Q96GG9 1/20 0.38

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
SCHEMBL21751247 0.79 PTPN1 (0.41) CETPPOLBPTPN1KCNN4EPHX1
SCHEMBL3074468 0.73 HSD17B10 (0.55) DCUN1D1
SCHEMBL5526402 0.72 CHRM2 (0.50) CETPEPHX1CHRM2CHRM1CHRM3
SCHEMBL5526398 0.72 EPHX1 (0.48) CETPEPHX1ROCK1ROCK2CHRM2
SCHEMBL5367845 0.71 EPHX1 (0.46) CETPEPHX1CHRM2CHRM1CHRM3
SCHEMBL28251101 0.71 CTSA (0.53) CTSA
SCHEMBL5009648 0.69 DAO (0.55) CETPCHRM2CHRM1CHRM3DAO
SCHEMBL6054525 0.69 CETP (0.43) CETPEPHX1FEN1CHRM2CHRM1
SCHEMBL178310 0.68 CHRM2 (0.55) CETPCHRM2CHRM1CHRM3DAO
SCHEMBL19062249 0.68 CETP (0.53) CETPROCK1ROCK2CHRM2CHRM1

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
US-20200060276-A1 THIAZOLE COMPOUND AND HERBICIDE OAT AGRIO CO., LTD. (JP) 2020-02-27 US disclosed
US-20200060276-A1 THIAZOLE COMPOUND AND HERBICIDE OAT AGRIO CO., LTD. (JP) 2020-02-27 US disclosed
CN-110325518-A Thiazolium compounds and herbicide 日本欧爱特农业科技株式会社 2019-10-11 CN 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 (1 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-20200060276-A1 THIAZOLE COMPOUND AND HERBICIDE OR10J3, OXSR1, OXER1 CTSA 4422/4885CETP 4708/4885POLB 4571/4885

“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.