SCHEMBL1451869

SCHEMBL1451869

O=C(C=C1CCCOc2cc(C(F)(F)F)ccc21)Nc1ccc2c(c1)C(=O)OC2

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
RXFP1 Q9HBX9 1/20 0.56
PPIA P62937 3/20 0.42
TRPV1 Q8NER1 5/20 0.42
IMPDH2 P12268 2/20 0.42
ALDH1A1 P00352 2/20 0.41
ROCK2 O75116 1/20 0.39
KDM4E B2RXH2 1/20 0.39
LMNA P02545 1/20 0.39
L3MBTL1 Q9Y468 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
SCHEMBL1451862 1.00 MEN1 (0.56) MEN1KMT2ARXFP1PPIATRPV1
SCHEMBL1450392 0.89 TRPV1 (0.42) MEN1KMT2ARXFP1TRPV1ROCK2
SCHEMBL1450913 0.87 TRPV1 (0.41) MEN1KMT2ARXFP1TRPV1ALDH1A1
SCHEMBL1450919 0.87 TRPV1 (0.41) MEN1KMT2ARXFP1TRPV1ALDH1A1
SCHEMBL1450631 0.86 TRPV1 (0.47) MEN1KMT2ARXFP1TRPV1ROCK2
SCHEMBL1450627 0.86 TRPV1 (0.47) MEN1KMT2ARXFP1TRPV1ROCK2
SCHEMBL3591854 0.86 TRPV1 (0.47) MEN1KMT2ARXFP1TRPV1
SCHEMBL1451013 0.86 TRPV1 (0.41) MEN1KMT2ARXFP1TRPV1ROCK2
SCHEMBL1451423 0.85 PARP10 (0.49) MEN1KMT2ARXFP1TRPV1ROCK2
SCHEMBL12629773 0.85 TRPV1 (0.54) MEN1KMT2ATRPV1ALDH1A1KDM4E

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8383839-B2 Heterocyclidene acetamide derivative MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2013-02-26 US claimed
US-20110112071-A1 NOVEL HETEROCYCLIDENE ACETAMIDE DERIVATIVE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2011-05-12 US claimed
US-8383839-B2 Heterocyclidene acetamide derivative MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2013-02-26 US disclosed
US-20110112071-A1 NOVEL HETEROCYCLIDENE ACETAMIDE DERIVATIVE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2011-05-12 US disclosed
US-20080287428-A1 Novel Heterocyclidene Acetamide Derivative MOCHIDA PHARMACEUTICAL CO.,LTD (JP) 2008-11-20 US disclosed
EP-1908753-A1 NOVEL HETEROCYCLIDENE ACETAMIDE DERIVATIVE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2008-04-09 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 (2 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-20080287428-A1 Novel Heterocyclidene Acetamide Derivative TRPV1, TRPV3, TRPA1 MEN1 4073/4885KMT2A 3094/4885RXFP1 336/4885
US-20110112071-A1 NOVEL HETEROCYCLIDENE ACETAMIDE DERIVATIVE TRPV1, TRPV3, TRPA1 MEN1 4073/4885KMT2A 3094/4885RXFP1 336/4885

“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.