SCHEMBL23309557

SCHEMBL23309557

O=C(Nc1ccc(C(F)(F)F)c(Cl)c1)c1cc(F)nc(F)c1F

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TMPRSS4 Q9NRS4 3/20 0.47
▸ KDR P35968 7/20 0.45
▸ FLT1 P17948 6/20 0.45
▸ GRM4 Q14833 3/20 0.44
▸ KCNQ3 O43525 1/20 0.42
▸ KCNQ2 O43526 1/20 0.42
▸ KCNE1 P15382 1/20 0.42
▸ KCNQ1 P51787 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ CNR2 P34972 1/20 0.42
▸ CHRM2 P08172 1/20 0.41
▸ CHRM4 P08173 1/20 0.41
▸ CHRM5 P08912 1/20 0.41
▸ CHRM1 P11229 1/20 0.41
▸ CHRM3 P20309 1/20 0.41
▸ STK39 Q9UEW8 1/20 0.41

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
SCHEMBL23309495 0.85 FADS1 (0.56) KMT2A
SCHEMBL23309715 0.83 SORT1 (0.46) TMPRSS4KDRFLT1GRM4KMT2A
SCHEMBL23309539 0.82 NPC1 (0.52) KMT2A
SCHEMBL23309531 0.82 MAOB (0.49) KDRGRM4KCNQ3KCNQ2KCNE1
SCHEMBL23309730 0.81 KMT2A (0.47) KMT2A
SCHEMBL23309546 0.80 NFKB1 (0.50) TMPRSS4KMT2A
SCHEMBL23309708 0.80 RAB9A (0.52) TMPRSS4KMT2A
SCHEMBL4969158 0.78 KCNQ3 (0.47) TMPRSS4KDRFLT1GRM4KCNQ3
SCHEMBL23309703 0.78 RAB9A (0.51) KCNQ3KCNQ2KMT2A
SCHEMBL23309502 0.77 NFKB1 (0.51) TMPRSS4KMT2A

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
US-20210120817-A1 PLANT DISEASE CONTROL AGENT MEIJI SEIKA PHARMA CO., LTD. (JP) 2021-04-29 — — 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 (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-20210120817-A1 PLANT DISEASE CONTROL AGENT BROX, ALG1, CTRL TMPRSS4 4429/4885KDR 4433/4885FLT1 2291/4885

“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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