SCHEMBL265364

SCHEMBL265364

O=C([C@@H](O)c1ccc(F)cc1)N(CCc1ccc(C(F)(F)F)cn1)c1ccc(Cl)c(CO)c1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
DAO P14920 1/20 0.34
P2RX7 Q99572 1/20 0.34
TRPV1 Q8NER1 5/20 0.33
POLQ O75417 4/20 0.33
MCHR1 Q99705 1/20 0.32
CNR1 P21554 1/20 0.32
HCRTR1 O43613 1/20 0.32
HCRTR2 O43614 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
TRPM8 Q7Z2W7 1/20 0.31
MLYCD O95822 1/20 0.31

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
SCHEMBL265363 1.00 MEN1 (0.38) MEN1KMT2ADAOP2RX7TRPV1
SCHEMBL265362 1.00 MEN1 (0.38) MEN1KMT2ADAOP2RX7TRPV1
SCHEMBL264248 0.93 MEN1 (0.36) MEN1KMT2ADAOP2RX7POLQ
SCHEMBL264250 0.93 MEN1 (0.36) MEN1KMT2ADAOP2RX7POLQ
SCHEMBL264249 0.93 MEN1 (0.36) MEN1KMT2ADAOP2RX7POLQ
SCHEMBL265228 0.92 DAO (0.36) MEN1KMT2ADAOTRPV1POLQ
SCHEMBL265227 0.92 DAO (0.36) MEN1KMT2ADAOTRPV1POLQ
SCHEMBL265229 0.92 DAO (0.36) MEN1KMT2ADAOTRPV1POLQ
SCHEMBL272360 0.88 MEN1 (0.35) MEN1KMT2ADAOP2RX7POLQ
SCHEMBL264285 0.86 MEN1 (0.39) MEN1KMT2ADAOPOLQMCHR1

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-8133909-B2 Heteroaromatic monoamides as orexinin receptor antagonists HOFFMANN-LA ROCHE INC. (US) 2012-03-13 US claimed
US-20090312314-A1 HETEROAROMATIC MONOAMIDES AS OREXININ RECEPTOR ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2009-12-17 US claimed
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 762/4885DAO 1311/4885

“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.