SCHEMBL3591854

SCHEMBL3591854

O=C(/C=C1\CCCOc2cc(C(F)(F)F)ccc21)Nc1ccc2c(c1)NC(=O)OC2

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 18/20 0.47
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
CSNK1A1 P48729 1/20 0.39
CRBN Q96SW2 1/20 0.39
IKZF2 Q9UKS7 1/20 0.39

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
SCHEMBL1450825 0.90 TRPV1 (0.59) TRPV1CSNK1A1CRBNIKZF2
SCHEMBL1451875 0.89 TRPV1 (0.52) TRPV1CSNK1A1CRBNIKZF2
SCHEMBL1451871 0.89 TRPV1 (0.52) TRPV1CSNK1A1CRBNIKZF2
SCHEMBL3584549 0.87 TRPV1 (0.47) TRPV1CSNK1A1CRBNIKZF2
SCHEMBL1451869 0.86 MEN1 (0.56) TRPV1MEN1KMT2ARXFP1
SCHEMBL1451862 0.86 MEN1 (0.56) TRPV1MEN1KMT2ARXFP1
SCHEMBL3598034 0.86 TRPV1 (0.46) TRPV1
SCHEMBL3594487 0.86 TRPV1 (0.60) TRPV1
SCHEMBL1451969 0.85 TRPV1 (0.55) TRPV1KMT2A
SCHEMBL3596112 0.85 TRPV1 (0.45) TRPV1CSNK1A1CRBNIKZF2

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 2518/4885MEN1 2424/4885KMT2A 906/4885

“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.