SCHEMBL23718893

SCHEMBL23718893

CCOC(=O)c1cnc(CBr)c(OC)c1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 12/20 0.52
▸ HSD17B2 P37059 1/20 0.51
▸ CYP2C9 P11712 1/20 0.47
▸ CYP2C19 P33261 1/20 0.47
▸ PDGFRB P09619 1/20 0.46
▸ PDGFRA P16234 1/20 0.46
▸ MAOB P27338 1/20 0.44
▸ KDM4E B2RXH2 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ NPC1 O15118 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ CA12 O43570 1/20 0.41
▸ CA1 P00915 1/20 0.41
▸ CA2 P00918 1/20 0.41
▸ CA7 P43166 1/20 0.41
▸ CA9 Q16790 1/20 0.41
▸ CA14 Q9ULX7 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
SCHEMBL29971159 1.00 DPP4 (0.52) DPP4HSD17B2CYP2C9CYP2C19PDGFRB
SCHEMBL21660272 0.87 MAPT (0.43) DPP4CYP2C9CYP2C19KDM4EMAPT
SCHEMBL20703109 0.84 CYP2C9 (0.50) DPP4CYP2C9CYP2C19MAOBMAPT
SCHEMBL26412821 0.84 CYP2C9 (0.50) DPP4CYP2C9CYP2C19MAOBCA12
SCHEMBL23714464 0.82 HSD17B2 (0.56) DPP4HSD17B2CYP2C9CYP2C19PDGFRB
SCHEMBL31023464 0.79 HSD17B2 (0.54) DPP4HSD17B2CYP2C9CYP2C19PDGFRB
SCHEMBL27393841 0.78 CYP2C9 (0.55) DPP4HSD17B2CYP2C9CYP2C19PDGFRB
SCHEMBL31527444 0.77 CYP2C9 (0.49) DPP4HSD17B2CYP2C9CYP2C19PDGFRB
SCHEMBL15350275 0.76 CYP2C9 (0.51) DPP4HSD17B2CYP2C9CYP2C19PDGFRB
SCHEMBL14466766 0.76 CYP2C9 (0.51) DPP4CYP2C9CYP2C19MAOBMAPT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230131192-A1 1H-PYRAZOLO[4,3-d]PYRIMIDINE COMPOUNDS AS TOLL-LIKE RECEPTOR 7 (TLR7) AGONISTS BRISTOL-MYERS SQUIBB COMPANY 2023-04-27 — — US disclosed
WO-2021154664-A1 1H-PYRAZOLO[4,3-d]PYRIMIDINE COMPOUNDS AS TOLL-LIKE RECEPTOR 7 (TLR7) AGONISTS BRISTOL-MYERS SQUIBB COMPANY (US) 2021-08-05 — — WO 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-20230131192-A1 1H-PYRAZOLO[4,3-d]PYRIMIDINE COMPOUNDS AS TOLL-LIKE RECEPTOR 7 (TLR7) AGONISTS TLR7, TLR9, TLR1 DPP4 933/4885HSD17B2 4539/4885CYP2C9 3968/4885

“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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