SCHEMBL3600645

SCHEMBL3600645

CCN1CCOc2c(NC(=O)C=C3CC(CC)(CC)Oc4cc(C(F)(F)F)ccc43)cccc21

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 11/20 0.40
ALDH1A1 P00352 3/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
CYSLTR2 Q9NS75 1/20 0.34
CYSLTR1 Q9Y271 1/20 0.34
KCNQ2 O43526 1/20 0.34
MAPT P10636 2/20 0.33
MEN1 O00255 1/20 0.33
TSHR P16473 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL3600643 1.00 TRPV1 (0.40) TRPV1ALDH1A1SMN1; SMN2CYSLTR2CYSLTR1
SCHEMBL3604162 0.93 TRPV1 (0.40) TRPV1ALDH1A1SMN1; SMN2CYSLTR2CYSLTR1
SCHEMBL3604164 0.93 TRPV1 (0.40) TRPV1ALDH1A1SMN1; SMN2CYSLTR2CYSLTR1
SCHEMBL3605280 0.93 TRPV1 (0.40) TRPV1ALDH1A1SMN1; SMN2CYSLTR2CYSLTR1
SCHEMBL3599796 0.93 TRPV1 (0.36) TRPV1ALDH1A1SMN1; SMN2CYSLTR2CYSLTR1
SCHEMBL3599799 0.93 TRPV1 (0.36) TRPV1ALDH1A1SMN1; SMN2CYSLTR2CYSLTR1
SCHEMBL3605282 0.93 TRPV1 (0.40) TRPV1ALDH1A1SMN1; SMN2CYSLTR2CYSLTR1
SCHEMBL3594177 0.92 TRPV1 (0.42) TRPV1ALDH1A1SMN1; SMN2KCNQ2MAPT
SCHEMBL3594179 0.92 TRPV1 (0.42) TRPV1ALDH1A1SMN1; SMN2KCNQ2MAPT
SCHEMBL3597684 0.86 CYSLTR2 (0.37) TRPV1ALDH1A1SMN1; SMN2CYSLTR2CYSLTR1

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 2518/4885ALDH1A1 1904/4885SMN1; SMN2 1047/4885

“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.