SCHEMBL23324957

SCHEMBL23324957

CCNc1cnc(C(=O)N(C)C(C)C)s1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ACACB O00763 3/20 0.34
▸ HCAR3 P49019 2/20 0.32
▸ HSD17B1 P14061 1/20 0.30
▸ HSD17B2 P37059 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
SCHEMBL25884614 0.82 HCAR3 (0.33) ACACBHCAR3HSD17B1HSD17B2
SCHEMBL23325913 0.70 HCAR3 (0.61) HCAR3
SCHEMBL25905785 0.70 ADRA2A (0.40) ACACBHCAR3
SCHEMBL23324960 0.69 HRH3 (0.34) ACACBHCAR3
SCHEMBL24127269 0.66 CYP1A2 (0.37) HSD17B1HSD17B2
SCHEMBL26077561 0.64 — —
SCHEMBL14038178 0.63 NPC1 (0.32) HCAR3
SCHEMBL12862942 0.58 ALDH1A1 (0.53) —
SCHEMBL12667404 0.58 HCAR3 (0.37) HCAR3
SCHEMBL25895254 0.58 ADORA3 (0.35) —

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-20230234929-A1 RAS INHIBITORS WILMINGTON TRUST, NATIONAL ASSOCIATION, AS AGENT 2023-07-27 — — US disclosed
US-11566007-B2 Ras inhibitors Revolution Medicines, Inc. (US) 2023-01-31 — — US disclosed
US-20210130303-A1 RAS INHIBITORS WILMINGTON TRUST, NATIONAL ASSOCIATION, AS AGENT 2021-05-06 — — 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-11566007-B2 Ras inhibitors KRAS, NRAS, HRAS ACACB 3273/4885HCAR3 4500/4885HSD17B1 4644/4885
US-20230234929-A1 RAS INHIBITORS KRAS, NRAS, HRAS ACACB 3273/4885HCAR3 4500/4885HSD17B1 4644/4885
US-20210130303-A1 RAS INHIBITORS KRAS, NRAS, HRAS ACACB 3273/4885HCAR3 4500/4885HSD17B1 4644/4885

“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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