SCHEMBL1180238

SCHEMBL1180238

CC(C)C(NC(=O)c1cccn2c(-c3ccc(NC(=O)OC(C)(C)C)cc3)nnc12)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ADAMTS4 O75173 1/20 0.41
▸ CSGALNACT1 Q8TDX6 10/20 0.40
▸ GPR139 Q6DWJ6 1/20 0.38
▸ DGAT1 O75907 3/20 0.38
▸ BRD4 O60885 1/20 0.38
▸ CYP17A1 P05093 2/20 0.38
▸ SDCBP O00560 1/20 0.37
▸ SDC2 P34741 1/20 0.37
▸ ELANE P08246 1/20 0.37
▸ L3MBTL1 Q9Y468 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
SCHEMBL1180234 1.00 ADAMTS4 (0.41) ADAMTS4CSGALNACT1GPR139DGAT1BRD4
SCHEMBL12872573 0.93 GPR139 (0.38) ADAMTS4GPR139BRD4CYP17A1ELANE
SCHEMBL12872574 0.91 CYP17A1 (0.40) ADAMTS4GPR139BRD4CYP17A1ELANE
SCHEMBL1179762 0.85 BRD9 (0.44) GPR139BRD4CYP17A1
SCHEMBL1180113 0.84 MAPT (0.48) CSGALNACT1DGAT1L3MBTL1
SCHEMBL1180109 0.84 MAPT (0.48) CSGALNACT1DGAT1L3MBTL1
SCHEMBL12872713 0.82 CSGALNACT1 (0.60) CSGALNACT1DGAT1
SCHEMBL1180372 0.82 MEN1 (0.46) CSGALNACT1DGAT1
SCHEMBL1180367 0.82 MEN1 (0.46) CSGALNACT1DGAT1
SCHEMBL1180305 0.82 MMP1 (0.40) CSGALNACT1DGAT1

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-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

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 ADAMTS4 2516/4885CSGALNACT1 617/4885GPR139 482/4885

“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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