SCHEMBL30236233

SCHEMBL30236233

CNc1ccc(Br)c(C)c1N

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PRKCI P41743 1/20 0.32
PTGER4 P35408 1/20 0.32
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30

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
SCHEMBL16831105 1.00 PRKCI (0.32) PRKCIPTGER4ALDH1A1MAPT
SCHEMBL16831571 0.78 PTGER4 (0.39) PTGER4ALDH1A1MAPT
SCHEMBL29442635 0.78 PTGER4 (0.39) PTGER4ALDH1A1MAPT
SCHEMBL27298134 0.77 CA1 (0.33) PRKCIPTGER4
SCHEMBL16831157 0.77 PTGER4 (0.53) PRKCIPTGER4ALDH1A1
SCHEMBL30620243 0.77 CA1 (0.33) PRKCIPTGER4
SCHEMBL29818977 0.76 PTGER4 (0.38) PTGER4ALDH1A1MAPT
SCHEMBL21713733 0.76 PTGER4 (0.38) PTGER4ALDH1A1MAPT
SCHEMBL20439755 0.75 IDO1 (0.38) PTGER4ALDH1A1MAPT
SCHEMBL26654848 0.74 ALOX5AP (0.36) PRKCIMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118206566-A Hydroxypyridooxazepine as NRF2 activator 葛兰素史密斯克莱知识产权发展有限公司 2024-06-18 CN disclosed
CN-113474349-B Hydroxypyridooxazepine as NRF2 activator 葛兰素史密斯克莱知识产权发展有限公司 2024-03-01 CN disclosed
US-20230047296-A1 Nrf2 REGULATORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2023-02-16 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-20230047296-A1 Nrf2 REGULATORS NFE2L2, KEAP1, NQO1 PRKCI 2194/4885PTGER4 1167/4885ALDH1A1 621/4885

“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.