SCHEMBL18957375

SCHEMBL18957375

CC(C)(C)C(=O)OCOC(=O)c1cccc2c1OB(O)[C@@H](NC(=O)CCC(F)(F)F)C2

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PRKCB P05771 1/20 0.34
▸ PRKCA P17252 1/20 0.34
▸ PRKCH P24723 1/20 0.34
▸ PRKCE Q02156 1/20 0.34
▸ PRKCD Q05655 1/20 0.34
▸ NAMPT P43490 1/20 0.33
▸ DRD2 P14416 1/20 0.30
▸ HTR2A P28223 1/20 0.30
▸ DRD3 P35462 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
SCHEMBL18957376 1.00 PRKCB (0.34) PRKCBPRKCAPRKCHPRKCEPRKCD
SCHEMBL18957319 0.96 PRKCB (0.35) PRKCBPRKCAPRKCHPRKCEPRKCD
SCHEMBL18957316 0.96 PRKCB (0.35) PRKCBPRKCAPRKCHPRKCEPRKCD
SCHEMBL18957225 0.95 PRKCB (0.34) PRKCBPRKCAPRKCHPRKCEPRKCD
SCHEMBL18957224 0.95 PRKCB (0.34) PRKCBPRKCAPRKCHPRKCEPRKCD
SCHEMBL18957264 0.93 NAMPT (0.33) PRKCBPRKCAPRKCHPRKCEPRKCD
SCHEMBL18957260 0.93 NAMPT (0.33) PRKCBPRKCAPRKCHPRKCEPRKCD
SCHEMBL18957040 0.92 NAMPT (0.33) PRKCBPRKCAPRKCHPRKCEPRKCD
SCHEMBL18957039 0.92 NAMPT (0.33) PRKCBPRKCAPRKCHPRKCEPRKCD
SCHEMBL18966551 0.92 PRKCB (0.33) PRKCBPRKCAPRKCHPRKCEPRKCD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10464952-B2 Beta-lactamase inhibitors VenatoRx Pharmaceuticals, Inc. (US) 2019-11-05 — — US disclosed
US-10464952-B2 Beta-lactamase inhibitors VenatoRx Pharmaceuticals, Inc. (US) 2019-11-05 — — US disclosed
US-20180291039-A1 BETA-LACTAMASE INHIBITORS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2018-10-11 — — US disclosed
WO-2017100537-A1 BETA-LACTAMASE INHIBITORS VenatoRx Pharmaceuticals, Inc. (US) 2017-06-15 — — WO disclosed
WO-2017100537-A1 BETA-LACTAMASE INHIBITORS VenatoRx Pharmaceuticals, Inc. (US) 2017-06-15 — — 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 (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-10464952-B2 Beta-lactamase inhibitors MGAM, GAA, LCT PRKCB 2479/4885PRKCA 2852/4885PRKCH 2897/4885
US-20180291039-A1 BETA-LACTAMASE INHIBITORS MGAM, GAA, LCT PRKCB 2479/4885PRKCA 2852/4885PRKCH 2897/4885

“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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