SCHEMBL32669425

SCHEMBL32669425

COc1ccc(CNc2nnccc2C(C)N)cc1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CDK1 P06493 3/20 0.44
▸ CCNB2 O95067 2/20 0.44
▸ CCNB1 P14635 2/20 0.44
▸ CCNB3 Q8WWL7 2/20 0.44
▸ APP P05067 1/20 0.44
▸ NPC1 O15118 3/20 0.43
▸ EGFR P00533 1/20 0.43
▸ POLB P06746 1/20 0.43
▸ NR2F2 P24468 1/20 0.43
▸ MAPT P10636 2/20 0.43
▸ RAB9A P51151 2/20 0.43
▸ SLC6A4 P31645 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ GAA P10253 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ CLK4 Q9HAZ1 1/20 0.41
▸ PRUNE1 Q86TP1 1/20 0.41

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
SCHEMBL27033740 0.83 NPC1 (0.57) CDK1CCNB2CCNB1CCNB3APP
SCHEMBL27089188 0.80 CCNE2 (0.45) CDK1CCNB2CCNB1CCNB3NPC1
SCHEMBL27089192 0.80 CCNE2 (0.45) CDK1CCNB2CCNB1CCNB3NPC1
SCHEMBL29998917 0.80 CCNE2 (0.45) CDK1CCNB2CCNB1CCNB3NPC1
SCHEMBL32669313 0.76 CDK1 (0.51) CDK1CCNB2CCNB1CCNB3APP
SCHEMBL32669370 0.74 PDE5A (0.51) APPNPC1EGFRPOLBNR2F2
SCHEMBL29998943 0.71 NPC1 (0.47) CDK1CCNB2CCNB1CCNB3APP
SCHEMBL27088883 0.71 NPC1 (0.47) CDK1CCNB2CCNB1CCNB3APP
SCHEMBL16290847 0.70 NPC1 (0.58) NPC1EGFRPOLBNR2F2MAPT
SCHEMBL29889719 0.70 NPC1 (0.58) NPC1EGFRPOLBNR2F2MAPT

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-20260034126-A1 KRAS INHIBITORS INCYTE CORP (US) 2026-02-05 — — 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-20260034126-A1 KRAS INHIBITORS KRAS, NRAS, HRAS CDK1 625/4885CCNB2 588/4885CCNB1 886/4885

“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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