SCHEMBL265564

SCHEMBL265564

N[C@@H](C(=O)N(CCc1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)nc1)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 4/20 0.40
SLC6A9 P48067 1/20 0.38
P2RX7 Q99572 1/20 0.38
PSEN1 P49768 2/20 0.38
PSEN2 P49810 2/20 0.38
APH1B Q8WW43 2/20 0.38
NCSTN Q92542 2/20 0.38
APH1A Q96BI3 2/20 0.38
PSENEN Q9NZ42 2/20 0.38
MLYCD O95822 1/20 0.38
PLAAT3 P53816 2/20 0.37
PLAAT5 Q96KN8 2/20 0.37
PLAAT2 Q9NWW9 2/20 0.37
PLAAT4 Q9UL19 2/20 0.37
TRPM8 Q7Z2W7 3/20 0.36
EEF2K O00418 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
GPR55 Q9Y2T6 1/20 0.36
MDM2 Q00987 1/20 0.36

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
SCHEMBL265563 1.00 TACR1 (0.40) TACR1SLC6A9P2RX7PSEN1PSEN2
SCHEMBL265565 1.00 TACR1 (0.40) TACR1SLC6A9P2RX7PSEN1PSEN2
SCHEMBL264115 0.88 TACR1 (0.39) TACR1TRPM8KMT2A
SCHEMBL264116 0.88 TACR1 (0.39) TACR1TRPM8KMT2A
SCHEMBL264114 0.88 TACR1 (0.39) TACR1TRPM8KMT2A
SCHEMBL8086085 0.85 TACR1 (0.42) TACR1SLC6A9MLYCDPLAAT3PLAAT5
SCHEMBL3649918 0.84 TACR1 (0.44) TACR1SLC6A9MLYCDMEN1KMT2A
SCHEMBL3643397 0.84 TACR1 (0.44) TACR1TRPM8MEN1KMT2AMDM2
SCHEMBL3645996 0.84 TACR1 (0.44) TACR1SLC6A9MLYCDMEN1KMT2A
SCHEMBL3645993 0.84 TACR1 (0.44) TACR1SLC6A9MLYCDMEN1KMT2A

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-8133909-B2 Heteroaromatic monoamides as orexinin receptor antagonists HOFFMANN-LA ROCHE INC. (US) 2012-03-13 US 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 TACR1 60/4885SLC6A9 4467/4885P2RX7 506/4885

“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.