SCHEMBL20972671

SCHEMBL20972671

CCOC(=O)CNC(=O)C(C#N)c1nc2ccc(Br)cc2s1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ LIPC P11150 16/20 0.49
▸ LIPG Q9Y5X9 16/20 0.49
▸ RAB9A P51151 2/20 0.41
▸ NPC1 O15118 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ DYRK1A Q13627 1/20 0.40

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
SCHEMBL19709505 0.86 LIPC (0.56) LIPCLIPGRAB9ANPC1CYP1A2
SCHEMBL20972710 0.85 LIPG (0.44) LIPCLIPG
SCHEMBL20972694 0.83 HPGD (0.44) LIPCLIPGCYP1A2CYP3A4CYP2C19
SCHEMBL19709504 0.80 LIPG (0.75) LIPCLIPG
SCHEMBL16899495 0.79 LIPG (0.51) LIPCLIPG
SCHEMBL19709507 0.78 LIPC (0.74) LIPCLIPG
SCHEMBL16907859 0.75 LIPG (0.55) LIPCLIPG
SCHEMBL18216850 0.71 LIPG (0.54) LIPCLIPG
SCHEMBL15464609 0.70 LIPC (0.51) LIPCLIPGRAB9ANPC1CYP1A2
SCHEMBL489108 0.70 RAB9A (0.52) RAB9ANPC1CYP1A2CYP3A4CYP2C9

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-10597370-B2 2-(benzothiazol-2-yl)-2-cyano-acetamide derivatives and their use as endothelial lipase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2020-03-24 — — US disclosed
US-20190144403-A1 2-(BENZOTHIAZOL-2-YL)-2-CYANO-ACETAMIDE DERIVATIVES AND THEIR USE AS ENDOTHELIAL LIPASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2019-05-16 — — 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 (2 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-20190144403-A1 2-(BENZOTHIAZOL-2-YL)-2-CYANO-ACETAMIDE DERIVATIVES AND THEIR USE AS ENDOTHELIAL LIPASE INHIBITORS LIPG, LPL, CEL LIPC 7/4885LIPG 1/4885RAB9A 4474/4885
US-10597370-B2 2-(benzothiazol-2-yl)-2-cyano-acetamide derivatives and their use as endothelial lipase inhibitors LIPG, LPL, CEL LIPC 7/4885LIPG 1/4885RAB9A 4474/4885

“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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