SCHEMBL22914760

SCHEMBL22914760

Cc1cc(N=O)cc(N=O)c1Cl

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.34
CHRM1 P11229 1/20 0.34
ALOX15 P16050 1/20 0.34
MAOA P21397 1/20 0.34
TBXA2R P21731 1/20 0.34
ADRA1A P35348 1/20 0.34
HTR2B P41595 1/20 0.34
TRPA1 O75762 1/20 0.31
LMNA P02545 1/20 0.30
HTT P42858 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
SCHEMBL28174120 0.74 BRD4 (0.38) CYP3A4TRPA1LMNAHTT
SCHEMBL14648592 0.74 ALDH1A1 (0.32) CYP3A4TRPA1LMNAHTT
SCHEMBL14470991 0.71 ALDH1A1 (0.33) CYP3A4LMNAHTT
SCHEMBL9063324 0.69 CYP3A4 (0.56) CYP3A4CHRM1ALOX15MAOATBXA2R
SCHEMBL19448946 0.69 CA12 (0.43) CYP3A4ALOX15LMNAHTT
SCHEMBL1274930 0.68 ALDH1A1 (0.38) CYP3A4ALOX15TRPA1LMNAHTT
SCHEMBL29577280 0.68 ALDH1A1 (0.38) CYP3A4ALOX15TRPA1LMNAHTT
SCHEMBL6050007 0.68 CYP3A4 (0.50) CYP3A4ALOX15TRPA1LMNAHTT
SCHEMBL11213752 0.68 BRD4 (0.40) CYP3A4ALOX15MAOAHTT
SCHEMBL27850945 0.68 CYP3A4 (0.35) CYP3A4

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-20210024455-A1 COMPOUND WHICH INHIBITS TELOMERE-BINDING PROTEIN, AND TELOMERE-BINDING PROTEIN INHIBITOR CONTAINING SAME HIROSHIMA UNIVERSITY (JP) 2021-01-28 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-20210024455-A1 COMPOUND WHICH INHIBITS TELOMERE-BINDING PROTEIN, AND TELOMERE-BINDING PROTEIN INHIBITOR CONTAINING SAME TERF2IP, TERF2, POT1 CYP3A4 4592/4885CHRM1 4815/4885ALOX15 3830/4885

“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.