SCHEMBL24222086

SCHEMBL24222086

CCNCn1cnc2c(=O)[nH]c(Cl)nc21

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PNP P00491 3/20 0.42
▸ HPGD P15428 1/20 0.42
▸ HPRT1 P00492 1/20 0.40
▸ TK1 P04183 2/20 0.40
▸ HSP90AA1 P07900 1/20 0.39
▸ HSP90AB1 P08238 1/20 0.39
▸ PDE1A P54750 1/20 0.39
▸ PDE1B Q01064 1/20 0.39
▸ PDE1C Q14123 1/20 0.39
▸ USP2 O75604 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ EDNRA P25101 1/20 0.39
▸ HTR2A P28223 1/20 0.39
▸ RECQL P46063 1/20 0.39
▸ BLM P54132 1/20 0.39
▸ HBB P68871 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ PDE5A O76074 1/20 0.38

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
SCHEMBL26199546 0.84 PNP (0.47) PNPHPGDHPRT1TK1HSP90AA1
SCHEMBL3424722 0.82 PDE1A (0.55) PNPHPGDHPRT1TK1PDE1A
SCHEMBL8301018 0.74 PNP (0.55) PNPHPRT1PDE1APDE1BPDE1C
SCHEMBL24499702 0.73 PNP (0.48) PNPHPRT1TK1PDE1APDE1B
SCHEMBL3427614 0.73 CDK1 (0.47) PNPHPGDTK1
SCHEMBL22326671 0.73 HPGD (0.43) PNPHPGDHPRT1TK1HSP90AA1
SCHEMBL12795899 0.72 PNP (0.56) PNPHPGD
SCHEMBL15293655 0.72 PNP (0.55) PNPHPGDHPRT1USP2TSHR
SCHEMBL13057471 0.72 PNP (0.53) PNPHPGDHSP90AA1HSP90AB1
SCHEMBL21942694 0.71 ADORA2A (0.46) PNPHPGDHPRT1HSP90AA1HSP90AB1

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-20220024964-A1 Cyclic Di-Nucleotide Compounds as STING Agonists MERCK SHARP & DOHME CORP. (US) 2022-01-27 — — 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-20220024964-A1 Cyclic Di-Nucleotide Compounds as STING Agonists STING1, CGAS, IFNAR1 PNP 384/4885HPGD 1482/4885HPRT1 223/4885

“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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