SCHEMBL15636591

SCHEMBL15636591

CCNc1cc(F)c(F)cc1C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.44
▸ MAPT P10636 3/20 0.44
▸ ALDH1A1 P00352 2/20 0.44
▸ HPGD P15428 2/20 0.44
▸ GAA P10253 2/20 0.44
▸ THRB P10828 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ GFER P55789 1/20 0.44
▸ PLEC Q15149 1/20 0.44
▸ CTSV O60911 2/20 0.43
▸ CTSL P07711 2/20 0.43
▸ ACLY P53396 1/20 0.42
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ HCAR3 P49019 1/20 0.40
▸ CISD1 Q9NZ45 3/20 0.39
▸ FTO Q9C0B1 1/20 0.39
▸ FABP4 P15090 1/20 0.38
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ AKR1C3 P42330 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
SCHEMBL28137209 0.84 MKNK1 (0.46) KDM4EMAPTALDH1A1HPGDGAA
SCHEMBL17363127 0.83 CISD1 (0.56) KDM4EMAPTALDH1A1HPGDGAA
SCHEMBL15636074 0.81 MEN1 (0.55) KDM4EMAPTALDH1A1HPGDCTSV
SCHEMBL15634988 0.81 CTSV (0.40) KDM4EMAPTALDH1A1HPGDCTSV
SCHEMBL15635250 0.79 CTSV (0.41) KDM4EMAPTALDH1A1HPGDCTSV
SCHEMBL13921285 0.79 CLCN2 (0.49) KDM4EMAPTALDH1A1HPGDGAA
SCHEMBL13073780 0.79 ALDH1A1 (0.49) KDM4EMAPTALDH1A1HPGDGAA
SCHEMBL15638807 0.78 PTGER4 (0.50) KDM4EMAPTALDH1A1HPGDCTSV
SCHEMBL23141190 0.77 PSIP1 (0.49) KDM4EMAPTALDH1A1HPGDACLY
SCHEMBL15639198 0.76 KDM4E (0.41) KDM4EMAPTALDH1A1HPGDCTSV

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104822653-B N-prop-2-ynylcarboxamide derivatives and their use as TRPA1 antagonists 奥赖恩公司 2017-03-08 — — CN disclosed
EP-2903965-B1 N-PROP-2-YNYL CARBOXAMIDE DERIVATIVES AND THEIR USE AS TRPA1 ANTAGONISTS ORION CORP (FI) 2017-03-01 — — EP disclosed
US-9533952-B2 N-prop-2-ynyl carboxamide derivatives and their use as TRPA1 antagonists ORION CORPORATION (FI) 2017-01-03 — — US disclosed
US-20150376130-A1 N-PROP-2-YNYL CARBOXAMIDE DERIVATIVES AND THEIR USE AS TRPA1 ANTAGONISTS Orlon Corporation (FI) 2015-12-31 — — US disclosed
EP-2903965-A1 N-PROP-2-YNYL CARBOXAMIDE DERIVATIVES AND THEIR USE AS TRPA1 ANTAGONISTS Orion Corporation (FI) 2015-08-12 — — EP disclosed
CN-104822653-A N-prop-2-ynylcarboxamide derivatives and their use as TRPA1 antagonists ORION CORP 2015-08-05 — — CN disclosed
WO-2014053694-A1 N-PROP-2-YNYL CARBOXAMIDE DERIVATIVES AND THEIR USE AS TRPA1 ANTAGONISTS ORION CORPORATION (FI) 2014-04-10 — — WO 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-20150376130-A1 N-PROP-2-YNYL CARBOXAMIDE DERIVATIVES AND THEIR USE AS TRPA1 ANTAGONISTS TRPA1, TRPV1, TRPV2 KDM4E 3536/4885MAPT 1793/4885ALDH1A1 1295/4885

“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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