SCHEMBL5669396

SCHEMBL5669396

O=C(O)CN1C(=O)C2(CCCC2)NCC1c1cc(F)cc(F)c1.[LiH]

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CALCRL Q16602 9/20 0.54
RAMP1 O60894 3/20 0.50
CALCA P06881 1/20 0.50
RIPK1 Q13546 1/20 0.35
KMT2A Q03164 3/20 0.34
MEN1 O00255 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL1272342 1.00 CALCRL (0.54) CALCRLRAMP1CALCARIPK1KMT2A
SCHEMBL3590576 0.99 CALCRL (0.54) CALCRLRAMP1CALCARIPK1KMT2A
SCHEMBL3592002 0.99 CALCRL (0.54) CALCRLRAMP1CALCARIPK1KMT2A
SCHEMBL3590594 0.99 CALCRL (0.54) CALCRLRAMP1CALCARIPK1KMT2A
Lithium Ion SCHEMBL1272339 0.87 CALCRL (0.51) CALCRLRAMP1CALCARIPK1KMT2A
SCHEMBL1274595 0.86 CALCRL (0.46) CALCRLRAMP1CALCAKMT2AMEN1
SCHEMBL17022981 0.84 CALCRL (0.42) CALCRLRAMP1CALCARIPK1
SCHEMBL12950639 0.83 CALCRL (0.48) CALCRLRAMP1CALCA
SCHEMBL12950641 0.83 CALCRL (0.48) CALCRLRAMP1CALCA
SCHEMBL3597448 0.83 CALCRL (0.46) CALCRLRAMP1CALCAKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070265225-A1 Substituted monocyclic CGRP receptor antagonists MERCK SHARP & DOHME LLC 2007-11-15 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-20070265225-A1 Substituted monocyclic CGRP receptor antagonists QRFPR, CALCRL, EDNRB CALCRL 2/4885RAMP1 70/4885CALCA 16/4885

“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.