SCHEMBL1179360

SCHEMBL1179360

CC(C)(C)OC(=O)Nc1ccc(-c2nnc3c(C(=O)O)cc(Cl)nn23)cc1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ BRD9 Q9H8M2 1/20 0.45
▸ BRD4 O60885 3/20 0.43
▸ PSMB8 P28062 1/20 0.43
▸ PTGDR2 Q9Y5Y4 1/20 0.42
▸ CYP17A1 P05093 3/20 0.42
▸ MAPT P10636 1/20 0.40
▸ MAP4K4 O95819 1/20 0.40
▸ P2RY14 Q15391 1/20 0.40
▸ MAPK14 Q16539 1/20 0.38
▸ CHRM1 P11229 1/20 0.37
▸ MAPKAPK2 P49137 1/20 0.37
▸ PRKDC P78527 1/20 0.37
▸ TTK P33981 1/20 0.37
▸ EGLN2 Q96KS0 1/20 0.37

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
SCHEMBL1180737 0.92 BRD9 (0.43) BRD9BRD4PSMB8PTGDR2CYP17A1
SCHEMBL1180447 0.83 PSMB8 (0.47) BRD9BRD4PSMB8PTGDR2CYP17A1
SCHEMBL1179762 0.77 BRD9 (0.44) BRD9BRD4PSMB8PTGDR2CYP17A1
SCHEMBL1180230 0.77 CYP17A1 (0.46) BRD9BRD4PSMB8PTGDR2CYP17A1
SCHEMBL1179959 0.72 CYP17A1 (0.48) BRD9BRD4PSMB8PTGDR2CYP17A1
SCHEMBL25432836 0.72 CYP17A1 (0.50) PSMB8PTGDR2CYP17A1MAP4K4P2RY14
SCHEMBL13666020 0.71 CYP17A1 (0.41) BRD9BRD4PSMB8CYP17A1MAPT
SCHEMBL12872702 0.70 BRD4 (0.45) BRD9BRD4PSMB8CYP17A1MAP4K4
SCHEMBL1179940 0.69 BRD4 (0.43) BRD9BRD4PSMB8PTGDR2CYP17A1
SCHEMBL16259909 0.69 BRD9 (0.68) BRD9BRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8324241-B2 Triazolo compounds useful as DGAT1 inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2012-12-04 — — US disclosed
US-20110034468-A1 TRIAZOLO COMPOUNDS USEFUL AS DGAT1 INHIBITORS BRISTOL-MEYERS SQUIBB COMPANY 2011-02-10 — — US disclosed
WO-2009126624-A1 TRIAZOLO COMPOUNDS USEFUL AS DGAT1 INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2009-10-15 — — 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-20110034468-A1 TRIAZOLO COMPOUNDS USEFUL AS DGAT1 INHIBITORS DGAT1, DGAT2, SOAT1 BRD9 1837/4885BRD4 1858/4885PSMB8 4481/4885

“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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