SCHEMBL6375814

SCHEMBL6375814

CC(C)n1cnc(CCCO)c1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CYP2C9 P11712 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ MTOR P42345 1/20 0.34
▸ HRH4 Q9H3N8 1/20 0.34
▸ HRH3 Q9Y5N1 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.33
▸ CPB2 Q96IY4 2/20 0.33
▸ CPA1 P15085 1/20 0.33
▸ CDK5 Q00535 1/20 0.33
▸ CDK5R1 Q15078 1/20 0.33
▸ CDK1 P06493 2/20 0.32
▸ CCNB1 P14635 1/20 0.32
▸ CDK2 P24941 1/20 0.31
▸ KDM5A P29375 1/20 0.31

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
SCHEMBL18161622 0.82 CYP2C9 (0.38) CYP2C9TSHRCYP2C19MTORHRH4
SCHEMBL11477981 0.81 CPA1 (0.35) CYP2C9TSHRCYP2C19MTORHRH4
SCHEMBL10495 0.79 CYP2C9 (0.37) CYP2C9TSHRCYP2C19MTORHRH4
SCHEMBL12015008 0.78 HRH4 (0.36) CYP2C9TSHRCYP2C19MTORHRH4
SCHEMBL1402037 0.78 CYP2C9 (0.58) CYP2C9TSHRCYP2C19MTORHRH4
SCHEMBL6132965 0.76 CYP2C9 (0.60) CYP2C9TSHRCYP2C19MTORHRH4
SCHEMBL1908703 0.75 HRH3 (0.41) CYP2C9TSHRCYP2C19MTORHRH4
SCHEMBL6124221 0.75 CPA1 (0.33) CYP2C9TSHRCYP2C19MTORHRH4
SCHEMBL6368933 0.74 CYP2C9 (0.33) CYP2C9TSHRCYP2C19MTORHRH4
SCHEMBL12226755 0.73 CPA1 (0.33) CYP2C9TSHRCYP2C19MTORHRH4

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-20050153964-A1 Pyrimidone compounds which are inhibitors of the enzyme Lp-PLA2; use in treating atheroscelerosis GLAXO GROUP LIMITED (GB) 2005-07-14 — — 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-20050153964-A1 Pyrimidone compounds which are inhibitors of the enzyme Lp-PLA2; use in treating atheroscelerosis LYPLAL1, PLA2G12A, ENPP2 CYP2C9 2467/4885TSHR 2563/4885CYP2C19 1056/4885

“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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