SCHEMBL20956371

SCHEMBL20956371

O=C(O)N1CCN(c2ccnc(Cl)n2)C1=O

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 12/20 0.41
▸ CYP17A1 P05093 3/20 0.35
▸ SORD Q00796 1/20 0.35
▸ RPS6KA5 O75582 1/20 0.34
▸ FFAR1 O14842 1/20 0.33

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
SCHEMBL20956347 0.81 SCN5A (0.42) TRPV1
SCHEMBL20956381 0.78 TRPV1 (0.48) TRPV1SORD
SCHEMBL19402116 0.78 IDH1 (0.47) TRPV1CYP17A1SORDRPS6KA5
SCHEMBL23019862 0.74 LCK (0.40) TRPV1CYP17A1SORDRPS6KA5
SCHEMBL19402233 0.74 CYP17A1 (0.40) TRPV1CYP17A1RPS6KA5
SCHEMBL19994354 0.72 ALOX5 (0.43) —
SCHEMBL4815499 0.72 TRPV1 (0.64) TRPV1SORD
SCHEMBL17600999 0.71 IDH1 (0.45) TRPV1RPS6KA5
SCHEMBL20956355 0.70 CDK4 (0.39) TRPV1
SCHEMBL16098462 0.70 IDH1 (0.48) TRPV1RPS6KA5

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
US-20200283406-A1 ANTIPROLIFERATIVE PYRIMIDINE-BASED COMPOUNDS G1 THERAPEUTICS, INC. (US) 2020-09-10 — — US disclosed
US-10654831-B2 Antiproliferative pyrimidine-based compounds G1 THERAPEUTICS, INC. (US) 2020-05-19 — — US disclosed
US-20190135784-A1 ANTIPROLIFERATIVE PYRIMIDINE-BASED COMPOUNDS G1 THERAPEUTICS, INC. (US) 2019-05-09 — — 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 (3 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-20190135784-A1 ANTIPROLIFERATIVE PYRIMIDINE-BASED COMPOUNDS MKI67, TYMS, TYMP TRPV1 4718/4885CYP17A1 3584/4885SORD 3269/4885
US-10654831-B2 Antiproliferative pyrimidine-based compounds MKI67, TYMS, TYMP TRPV1 4718/4885CYP17A1 3584/4885SORD 3269/4885
US-20200283406-A1 ANTIPROLIFERATIVE PYRIMIDINE-BASED COMPOUNDS MKI67, TYMS, TYMP TRPV1 4718/4885CYP17A1 3584/4885SORD 3269/4885

“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.

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