SCHEMBL3527412

SCHEMBL3527412

O=C1Cc2ncnc(Cl)c2N1

nearest known ligand 0.38

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AHR P35869 3/20 0.38
CMA1 P23946 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
SCHEMBL19153747 0.77 SRC (0.32) AHR
SCHEMBL260293 0.73 TNNI3K (0.39) AHRCMA1
SCHEMBL18238551 0.73 MEN1 (0.31)
SCHEMBL24138418 0.69 GSK3A (0.36)
SCHEMBL15964656 0.68 CRBN (0.38)
SCHEMBL29545667 0.64 DAO (0.37) AHRCMA1
SCHEMBL1531608 0.64 AKT1 (0.37)
SCHEMBL659718 0.64 PDE3A (0.37) AHR
SCHEMBL15386171 0.63 BCL6 (0.40) AHRCMA1
SCHEMBL24191776 0.62 GRIA1 (0.36) AHRCMA1

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-7659300-B2 Monocyclic anilide spirolactam CGRP receptor antagonists MERCK SHARP & DOHME CORP. (US) 2010-02-09 US disclosed
US-20090054408-A1 Monocyclic anilide spirolactam cgrp receptor antagonists MERCK SHARP & DOHME LLC 2009-02-26 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-20090054408-A1 Monocyclic anilide spirolactam cgrp receptor antagonists BDKRB1, BDKRB2, CALCRL AHR 2616/4885CMA1 1197/4885

“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.