SCHEMBL25897329

SCHEMBL25897329

CCc1ccnc(CC(C)c2ncc(C)cn2)n1

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ APLNR P35414 5/20 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
SCHEMBL20371518 0.86 SORD (0.34) —
SCHEMBL18950388 0.81 APLNR (0.35) APLNR
SCHEMBL19919582 0.76 APLNR (0.36) APLNR
SCHEMBL830187 0.71 CYP1A2 (0.37) —
Ammonia Solution, Strong SCHEMBL28652832 0.69 CYP1A2 (0.36) —
Ammonia Solution, Strong SCHEMBL11451734 0.68 CYP1A2 (0.35) —
SCHEMBL22395438 0.67 APLNR (0.50) APLNR
SCHEMBL19123072 0.67 APLNR (0.50) APLNR
SCHEMBL25888171 0.67 SORD (0.38) —
SCHEMBL23015778 0.67 TRPV3 (0.38) —

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-20230234955-A1 METHOD OF TREATMENT USING SUBSTITUTED PYRAZOLO[1,5-A] PYRIMIDINE COMPOUNDS ARRAY BIOPHARMA INC (US) 2023-07-27 — — 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-20230234955-A1 METHOD OF TREATMENT USING SUBSTITUTED PYRAZOLO[1,5-A] PYRIMIDINE COMPOUNDS TYMP, TYMS, TK1 APLNR 2971/4885

“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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