SCHEMBL14248139

SCHEMBL14248139

C=CC(C)CCCC(C)C(NC(=O)OC(C)(C)C)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CTSK P43235 13/20 0.42
▸ CTSS P25774 5/20 0.42
▸ MEN1 O00255 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ CA1 P00915 1/20 0.38
▸ CA2 P00918 1/20 0.38
▸ CA7 P43166 1/20 0.38
▸ CYP2D6 P10635 1/20 0.35
▸ CTSL P07711 1/20 0.35
▸ CTSB P07858 1/20 0.35

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
SCHEMBL14248067 1.00 CTSK (0.42) CTSKCTSSMEN1GAAKMT2A
SCHEMBL14318518 0.86 SMN1; SMN2 (0.42) CTSKCTSSCTSL
SCHEMBL15005809 0.85 CTSK (0.37) CTSKCTSSCA1CA2CA7
SCHEMBL24067299 0.82 CTSK (0.55) CTSKCTSSMEN1GAAKMT2A
SCHEMBL17627333 0.82 CTSK (0.47) CTSKCTSSMEN1GAAKMT2A
SCHEMBL17498476 0.82 CTSK (0.47) CTSKCTSSMEN1GAAKMT2A
SCHEMBL22359140 0.81 CTSK (0.46) CTSKCTSSMEN1GAAKMT2A
SCHEMBL12658511 0.81 CTSK (0.50) CTSKCTSSMEN1GAAKMT2A
SCHEMBL21419058 0.79 CTSK (0.52) CTSKCTSSMEN1GAAKMT2A
SCHEMBL28000286 0.79 CTSK (0.52) CTSKCTSSMEN1GAAKMT2A

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
EP-2721053-B1 HEPATITIS C VIRUS INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2016-10-19 — — EP disclosed
EP-2721053-A1 HEPATITIS C VIRUS INHIBITORS Bristol-Myers Squibb Company (US) 2014-04-23 — — EP disclosed
US-20130142754-A1 Hepatitis C Virus Inhibitors BRISTOL-MYERS SQUIBB COMPANY 2013-06-06 — — US disclosed
WO-2012173983-A1 HEPATITIS C VIRUS INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2012-12-20 — — 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-20130142754-A1 Hepatitis C Virus Inhibitors HAVCR2, HCCS, GOT1 CTSK 945/4885CTSS 1082/4885MEN1 4761/4885

“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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