SCHEMBL31739412

SCHEMBL31739412

c1c2c(nn1C1COC1)CCCNC2

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ KDM5A P29375 1/20 0.31
▸ HDAC1 Q13547 1/20 0.30
▸ HDAC2 Q92769 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
SCHEMBL30793334 0.86 KDM5A (0.34) KDM5A
SCHEMBL30793127 0.85 AADAT (0.37) KDM5A
SCHEMBL20792765 0.78 OGA (0.42) —
SCHEMBL29373389 0.77 HTR2C (0.39) KDM5A
SCHEMBL12706924 0.77 HTR2C (0.36) KDM5A
Hydrochloric Acid SCHEMBL20764966 0.77 OGA (0.41) —
SCHEMBL16210607 0.76 HTR2C (0.36) KDM5A
Hydrochloric Acid SCHEMBL1020680 0.76 HTR2C (0.35) KDM5A
SCHEMBL23641909 0.69 HTR2C (0.35) —
SCHEMBL17214083 0.68 AADAT (0.37) —

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-20250368649-A1 TETRAHYDROPYRIDOPYRIMIDINE PAN-KRAS INHIBITORS MIRATI THERAPEUTICS INC (US) 2025-12-04 — — 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-20250368649-A1 TETRAHYDROPYRIDOPYRIMIDINE PAN-KRAS INHIBITORS KRAS, NRAS, HRAS KDM5A 2920/4885HDAC1 2754/4885HDAC2 4130/4885

“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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