SCHEMBL3606694

SCHEMBL3606694

O=C(/C=C1\CC2(CCC2)Oc2cc(C(F)(F)F)ccc21)Nc1cccc2c1OCCN2CCO

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 6/20 0.34
CYSLTR2 Q9NS75 1/20 0.33
CYSLTR1 Q9Y271 1/20 0.33
KCNQ2 O43526 1/20 0.33
TRPM8 Q7Z2W7 2/20 0.32
NPY5R Q15761 1/20 0.32

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
SCHEMBL3606697 1.00 TRPV1 (0.34) TRPV1CYSLTR2CYSLTR1KCNQ2TRPM8
SCHEMBL3601007 0.96 CYSLTR2 (0.35) TRPV1CYSLTR2CYSLTR1KCNQ2TRPM8
SCHEMBL3601008 0.96 CYSLTR2 (0.35) TRPV1CYSLTR2CYSLTR1KCNQ2TRPM8
SCHEMBL3588769 0.90 TRPV1 (0.35) TRPV1KCNQ2TRPM8
SCHEMBL3588770 0.90 TRPV1 (0.35) TRPV1KCNQ2TRPM8
SCHEMBL3604162 0.88 TRPV1 (0.40) TRPV1CYSLTR2CYSLTR1
SCHEMBL3604164 0.88 TRPV1 (0.40) TRPV1CYSLTR2CYSLTR1
SCHEMBL3604428 0.86 TRPV1 (0.35) TRPV1CYSLTR2CYSLTR1
SCHEMBL3604432 0.86 TRPV1 (0.35) TRPV1CYSLTR2CYSLTR1
SCHEMBL3599786 0.86 RAF1 (0.36) TRPV1TRPM8

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
US-20100016285-A1 HETEROCYCLIDENE-N-(ARYL) ACETAMIDE DERIVATIVE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2010-01-21 US disclosed
US-20100016285-A1 HETEROCYCLIDENE-N-(ARYL) ACETAMIDE DERIVATIVE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2010-01-21 US disclosed
US-20100016285-A1 HETEROCYCLIDENE-N-(ARYL) ACETAMIDE DERIVATIVE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2010-01-21 US disclosed
EP-2128157-A1 HETEROCYCLIDENE-N-(ARYL)ACETAMIDE DERIVATIVE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2009-12-02 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-20100016285-A1 HETEROCYCLIDENE-N-(ARYL) ACETAMIDE DERIVATIVE CCNY, CCND3, NSD3 TRPV1 2518/4885CYSLTR2 1366/4885CYSLTR1 1492/4885

“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.