SCHEMBL23387366

SCHEMBL23387366

O=C(O)N[C@@H]1CCN(c2ncc(C(F)(F)F)cn2)C1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 5/20 0.47
KMT2A Q03164 1/20 0.47
TRPM8 Q7Z2W7 1/20 0.47
CHRM4 P08173 8/20 0.46
CA12 O43570 6/20 0.46
CA1 P00915 6/20 0.46
CA2 P00918 6/20 0.46
CA4 P22748 6/20 0.46
CA7 P43166 6/20 0.46
CA9 Q16790 6/20 0.46
CHRM2 P08172 2/20 0.46
CHRM5 P08912 1/20 0.44
CHRM1 P11229 1/20 0.44
CHRM3 P20309 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
SCHEMBL23387368 1.00 TRPV1 (0.47) TRPV1KMT2ATRPM8CHRM4CA12
SCHEMBL27233738 1.00 TRPV1 (0.47) TRPV1KMT2ATRPM8CHRM4CA12
SCHEMBL27173030 0.92 CHRM2 (0.45) TRPV1KMT2ATRPM8CHRM4CHRM2
SCHEMBL19741408 0.89 CHRM4 (0.54) CHRM4CHRM2CHRM1
SCHEMBL5575433 0.84 TRPV1 (0.66) TRPV1KMT2ATRPM8CA12CA1
SCHEMBL23297157 0.84 CHRM2 (0.42) CHRM4CHRM2CHRM5CHRM1CHRM3
SCHEMBL23297149 0.84 CHRM2 (0.42) CHRM4CHRM2CHRM5CHRM1CHRM3
SCHEMBL23297154 0.84 CHRM2 (0.42) CHRM4CHRM2CHRM5CHRM1CHRM3
SCHEMBL23297073 0.84 CHRM2 (0.42) CHRM4CHRM2CHRM5CHRM1CHRM3
SCHEMBL23296926 0.84 CHRM2 (0.42) CHRM4CHRM2CHRM5CHRM1CHRM3

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-4378938-A1 NOVEL PARP7 INHIBITOR AND USE THEREOF Shanghai Qilu Pharmaceutical Research and Development Centre Ltd. (CN) 2024-06-05 EP disclosed
US-20220226299-A1 USE OF T-TYPE CALCIUM CHANNEL BLOCKER FOR TREATING PRURITUS NIPPON CHEMIPHAR CO., LTD. (JP) 2022-07-21 US disclosed
EP-3950059-A1 USE OF T-TYPE CALCIUM CHANNEL BLOCKER FOR TREATING PRURITUS Nippon Chemiphar Co., Ltd. (JP) 2022-02-09 EP disclosed
EP-3825303-A1 T-TYPE CALCIUM CHANNEL BLOCKER Nippon Chemiphar Co., Ltd. (JP) 2021-05-26 EP 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-20220226299-A1 USE OF T-TYPE CALCIUM CHANNEL BLOCKER FOR TREATING PRURITUS TRPV3, CACNA1G, TRPV2 TRPV1 7/4885KMT2A 2174/4885TRPM8 27/4885

“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.