SCHEMBL17349765

SCHEMBL17349765

CC(C)(C)C(=O)OCOC(=O)c1cccc2c1OB(O)[C@@H](NC(=O)c1ccccc1O)C2

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PRKCB P05771 1/20 0.40
▸ PRKCA P17252 1/20 0.40
▸ PRKCH P24723 1/20 0.40
▸ PRKCE Q02156 1/20 0.40
▸ PRKCD Q05655 1/20 0.40
▸ ADRB2 P07550 1/20 0.35
▸ ADRB1 P08588 1/20 0.35
▸ ADRB3 P13945 1/20 0.35
▸ TAS1R3 Q7RTX0 3/20 0.35
▸ TAS1R1 Q7RTX1 3/20 0.35
▸ TAS1R2 Q8TE23 3/20 0.35
▸ NR1H2 P55055 1/20 0.34
▸ NPC1 O15118 5/20 0.33
▸ RAB9A P51151 5/20 0.33
▸ LMNA P02545 3/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ HTT P42858 2/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ TBXA2R P21731 1/20 0.32

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
SCHEMBL17349894 0.91 ADRB2 (0.35) PRKCBPRKCAPRKCHPRKCEPRKCD
SCHEMBL17349989 0.90 PRKCB (0.40) PRKCBPRKCAPRKCHPRKCEPRKCD
SCHEMBL17349881 0.89 KMT2A (0.39) TAS1R3TAS1R1NR1H2TBXA2RNAMPT
SCHEMBL17349888 0.89 ADRB2 (0.39) ADRB2ADRB1ADRB3CDC25BMEN1
SCHEMBL17349759 0.88 PRKCE (0.48) PRKCBPRKCAPRKCHPRKCEPRKCD
SCHEMBL17337516 0.88 PRKCB (0.35) PRKCBPRKCAPRKCHPRKCEPRKCD
SCHEMBL17349884 0.88 CDC25B (0.43) TAS1R3TAS1R1TAS1R2NPC1RAB9A
SCHEMBL17337512 0.88 PRKCB (0.35) PRKCBPRKCAPRKCHPRKCEPRKCD
SCHEMBL17349891 0.87 PRKCB (0.41) PRKCBPRKCAPRKCHPRKCEPRKCD
SCHEMBL17349901 0.86 PRKCB (0.36) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150361107-A1 ORALLY BIOAVAILABLE BETA-LACTAMASE INHIBITORS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-12-17 — — 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-20150361107-A1 ORALLY BIOAVAILABLE BETA-LACTAMASE INHIBITORS SI, ALPI, GAA PRKCB 3762/4885PRKCA 3994/4885PRKCH 3852/4885

“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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