SCHEMBL14718602

SCHEMBL14718602

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

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NR1H2 P55055 3/20 0.39
DDB1 Q16531 2/20 0.39
CRBN Q96SW2 2/20 0.39
ESR2 Q92731 1/20 0.37
ADORA1 P30542 2/20 0.36
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36
THRB P10828 1/20 0.36
MAPK1 P28482 1/20 0.36
GPR119 Q8TDV5 1/20 0.36
HDAC1 Q13547 1/20 0.35
HPGD P15428 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
SCHEMBL14719429 0.83 USP2 (0.42) USP2SMN1; SMN2NR1H2DDB1CRBN
SCHEMBL31080015 0.82 USP2 (0.50) USP2SMN1; SMN2NR1H2DDB1CRBN
SCHEMBL13801225 0.75 USP2 (0.50) USP2SMN1; SMN2NR1H2ESR2MAPK1
SCHEMBL120243 0.75 USP2 (0.50) USP2SMN1; SMN2NR1H2DDB1CRBN
SCHEMBL20984021 0.75 USP2 (0.43) USP2SMN1; SMN2NR1H2DDB1CRBN
SCHEMBL4767496 0.74 USP2 (0.40) USP2SMN1; SMN2NR1H2DDB1CRBN
SCHEMBL14719295 0.74 USP30 (0.44) DDB1CRBNKDM4EMAPK1GPR119
SCHEMBL17081081 0.73 USP2 (0.42) USP2SMN1; SMN2NR1H2DDB1CRBN
SCHEMBL2292608 0.73 USP2 (0.52) USP2SMN1; SMN2NR1H2DDB1CRBN
SCHEMBL15248097 0.72 USP2 (0.41) USP2SMN1; SMN2NR1H2DDB1CRBN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 1531/4885NR1H2 2603/4885

“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.