SCHEMBL13716589

SCHEMBL13716589

CCC[C@H]1C=C[C@@H](CCC)SC1C(=O)Nc1c(SC)cc(C)nc1SC

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ SOAT1 P35610 6/20 0.37
▸ KDM4E B2RXH2 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ MEN1 O00255 1/20 0.30
▸ KMT2A Q03164 1/20 0.30

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
SCHEMBL13716530 0.92 SOAT1 (0.36) SOAT1
SCHEMBL13716632 0.91 SOAT1 (0.35) SOAT1
SCHEMBL13716586 0.91 SOAT1 (0.35) SOAT1
SCHEMBL13716597 0.90 SOAT1 (0.35) SOAT1
SCHEMBL9008269 0.79 SOAT1 (0.39) SOAT1
SCHEMBL9008076 0.75 SOAT1 (0.36) SOAT1KDM4E
SCHEMBL9008152 0.75 SOAT1 (0.36) SOAT1KDM4E
SCHEMBL9008128 0.75 SOAT1 (0.36) SOAT1
SCHEMBL9008115 0.74 SOAT1 (0.39) SOAT1CYP1A2
SCHEMBL9008139 0.74 SOAT1 (0.35) SOAT1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7569590-B2 Use of thianecarboxamides as dgat inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2009-08-04 — — US disclosed
US-7569590-B2 Use of thianecarboxamides as dgat inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2009-08-04 — — US disclosed
US-20080090876-A1 USE OF THIANECARBOXAMIDES AS DGAT INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2008-04-17 — — US disclosed
US-20080090876-A1 USE OF THIANECARBOXAMIDES AS DGAT INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2008-04-17 — — 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-20080090876-A1 USE OF THIANECARBOXAMIDES AS DGAT INHIBITORS DGAT1, DGAT2, DLAT SOAT1 7/4885KDM4E 2765/4885ALDH1A1 356/4885

“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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