SCHEMBL265378

SCHEMBL265378

CS(=O)(=O)O[C@@H](C(=O)N(CCc1ccc(C(F)(F)F)nc1)c1ccc2c(c1)CCCC2)c1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
TRPM8 Q7Z2W7 3/20 0.36
EP300 Q09472 1/20 0.35
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
TSHR P16473 1/20 0.34
CYP2C19 P33261 1/20 0.34
SCN5A Q14524 1/20 0.33
SCN9A Q15858 1/20 0.33
NR1H2 P55055 6/20 0.33
NR1H3 Q13133 5/20 0.33
KCNH2 Q12809 1/20 0.33
TACR1 P25103 1/20 0.33
MOGAT2 Q3SYC2 1/20 0.33
PPARD Q03181 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
SCHEMBL265377 1.00 MEN1 (0.37) MEN1KMT2ATRPM8EP300KDM4E
SCHEMBL265116 0.86 SCN5A (0.36) MEN1KMT2ATRPM8EP300KDM4E
SCHEMBL265115 0.86 SCN5A (0.36) MEN1KMT2ATRPM8EP300KDM4E
SCHEMBL266707 0.86 PRMT5 (0.36) MEN1KMT2ATRPM8EP300KDM4E
SCHEMBL266655 0.86 PRMT5 (0.36) MEN1KMT2ATRPM8EP300KDM4E
SCHEMBL266654 0.86 PRMT5 (0.36) MEN1KMT2ATRPM8EP300KDM4E
SCHEMBL272261 0.83 TRPV1 (0.35) MEN1KMT2AALDH1A1MOGAT2
SCHEMBL267431 0.81 EP300 (0.39) TRPM8EP300KDM4EALDH1A1CYP1A2
SCHEMBL267433 0.81 EP300 (0.39) TRPM8EP300KDM4EALDH1A1CYP1A2
SCHEMBL267432 0.81 EP300 (0.39) TRPM8EP300KDM4EALDH1A1CYP1A2

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-8133909-B2 Heteroaromatic monoamides as orexinin receptor antagonists HOFFMANN-LA ROCHE INC. (US) 2012-03-13 US disclosed
EP-2297102-A1 HETEROAROMATIC MONOAMIDES AS OREXININ RECEPTOR ANTAGONISTS F. Hoffmann-La Roche AG (CH) 2011-03-23 EP disclosed
WO-2009153180-A1 HETEROAROMATIC MONOAMIDES AS OREXININ RECEPTOR ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2009-12-23 WO disclosed
US-20090312314-A1 HETEROAROMATIC MONOAMIDES AS OREXININ RECEPTOR ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2009-12-17 US 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-20090312314-A1 HETEROAROMATIC MONOAMIDES AS OREXININ RECEPTOR ANTAGONISTS HCRTR2, HCRTR1, NPSR1 MEN1 1019/4885KMT2A 762/4885TRPM8 386/4885

“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.