SCHEMBL3605282

SCHEMBL3605282

CCC1(CC)CC(=CC(=O)Nc2cccc3c2OCCN3CCCO)c2ccc(C(F)(F)F)cc2O1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 12/20 0.40
CYSLTR2 Q9NS75 1/20 0.35
CYSLTR1 Q9Y271 1/20 0.35
ALDH1A1 P00352 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
KCNQ2 O43526 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
SCHEMBL3605280 1.00 TRPV1 (0.40) TRPV1CYSLTR2CYSLTR1ALDH1A1SMN1; SMN2
SCHEMBL3604164 0.96 TRPV1 (0.40) TRPV1CYSLTR2CYSLTR1ALDH1A1SMN1; SMN2
SCHEMBL3604162 0.96 TRPV1 (0.40) TRPV1CYSLTR2CYSLTR1ALDH1A1SMN1; SMN2
SCHEMBL3597686 0.93 CYSLTR2 (0.37) TRPV1CYSLTR2CYSLTR1ALDH1A1SMN1; SMN2
SCHEMBL3597684 0.93 CYSLTR2 (0.37) TRPV1CYSLTR2CYSLTR1ALDH1A1SMN1; SMN2
SCHEMBL3600645 0.93 TRPV1 (0.40) TRPV1CYSLTR2CYSLTR1ALDH1A1SMN1; SMN2
SCHEMBL3600643 0.93 TRPV1 (0.40) TRPV1CYSLTR2CYSLTR1ALDH1A1SMN1; SMN2
SCHEMBL3594177 0.90 TRPV1 (0.42) TRPV1ALDH1A1SMN1; SMN2KCNQ2
SCHEMBL3594179 0.90 TRPV1 (0.42) TRPV1ALDH1A1SMN1; SMN2KCNQ2
SCHEMBL3601007 0.89 CYSLTR2 (0.35) TRPV1CYSLTR2CYSLTR1ALDH1A1KCNQ2

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 2 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
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.