SCHEMBL14719429

SCHEMBL14719429

CC1=C(C)C(=O)CN(C(=O)OC(C)(C)C)C1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
DDB1 Q16531 2/20 0.40
CRBN Q96SW2 2/20 0.40
ESR2 Q92731 1/20 0.38
NR1H2 P55055 4/20 0.38
GPR119 Q8TDV5 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MAPT P10636 1/20 0.38
THRB P10828 1/20 0.38
MAPK1 P28482 1/20 0.38
HDAC1 Q13547 1/20 0.36
HPGD P15428 1/20 0.36

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
SCHEMBL31080015 0.85 USP2 (0.50) USP2SMN1; SMN2DDB1CRBNESR2
SCHEMBL13801225 0.85 USP2 (0.50) USP2SMN1; SMN2ESR2NR1H2GPR119
SCHEMBL14718602 0.83 USP2 (0.40) USP2SMN1; SMN2DDB1CRBNESR2
SCHEMBL14719273 0.81 USP2 (0.45) USP2SMN1; SMN2ESR2NR1H2GPR119
SCHEMBL14732486 0.79 USP2 (0.36) USP2SMN1; SMN2DDB1CRBNESR2
SCHEMBL120243 0.77 USP2 (0.50) USP2SMN1; SMN2DDB1CRBNESR2
SCHEMBL14719036 0.77 DDB1 (0.34) USP2SMN1; SMN2DDB1CRBNESR2
SCHEMBL14719034 0.77 DDB1 (0.34) USP2SMN1; SMN2DDB1CRBNESR2
SCHEMBL16224510 0.77 USP2 (0.43) USP2SMN1; SMN2ESR2NR1H2GPR119
SCHEMBL12435353 0.77 NR1H2 (0.44) USP2SMN1; SMN2ESR2NR1H2GPR119

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-2834239-B1 HETEROBICYCLIC COMPOUNDS AS BETA-LACTAMASE INHIBITORS ENTASIS THERAPEUTICS LTD (GB) 2017-12-27 EP disclosed
US-20130053565-A1 SUBSTITUTED 3-PIPERIDONE COMPOUNDS UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2013-02-28 US disclosed
US-20130053565-A1 SUBSTITUTED 3-PIPERIDONE COMPOUNDS UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2013-02-28 US disclosed
US-20130053565-A1 SUBSTITUTED 3-PIPERIDONE COMPOUNDS UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2013-02-28 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-20130053565-A1 SUBSTITUTED 3-PIPERIDONE COMPOUNDS HTR3C, NPEPPS, RAP2C USP2 3442/4885SMN1; SMN2 1531/4885DDB1 4744/4885

“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.