SCHEMBL3604382

SCHEMBL3604382

CN1c2cccc(NC(=O)C=C3CC(C)(C)Oc4cc(C(F)(F)F)ccc43)c2CCS1(=O)=O

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 13/20 0.43
PTGES O14684 5/20 0.33
ALDH1A1 P00352 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ALOX5 P09917 1/20 0.33
TP53 P04637 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
SCHEMBL3604379 1.00 TRPV1 (0.43) TRPV1PTGESALDH1A1SMN1; SMN2ALOX5
SCHEMBL3601660 0.90 TRPV1 (0.37) TRPV1
SCHEMBL3604556 0.90 TRPV1 (0.45) TRPV1
SCHEMBL3601659 0.90 TRPV1 (0.37) TRPV1
SCHEMBL3604558 0.90 TRPV1 (0.45) TRPV1
SCHEMBL3598158 0.89 TRPV1 (0.37) TRPV1ALDH1A1SMN1; SMN2
SCHEMBL3598156 0.89 TRPV1 (0.37) TRPV1ALDH1A1SMN1; SMN2
SCHEMBL3596950 0.88 TRPV1 (0.39) TRPV1
SCHEMBL3596949 0.88 TRPV1 (0.39) TRPV1
SCHEMBL3595769 0.85 TRPV1 (0.44) TRPV1ALDH1A1

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 2518/4885PTGES 3412/4885ALDH1A1 1904/4885

“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.