SCHEMBL18280996

SCHEMBL18280996

CC(C)(C)OC(=O)N1CC/C(=C/C(=O)O)C(F)(F)C1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ESR2 Q92731 1/20 0.39
ADORA1 P30542 1/20 0.38
NR1H2 P55055 1/20 0.38
GRM5 P41594 3/20 0.36
GRM1 Q13255 2/20 0.36
USP30 Q70CQ3 2/20 0.36
GPR119 Q8TDV5 1/20 0.36
RORC P51449 3/20 0.35
KDM4E B2RXH2 1/20 0.35
MAPT P10636 1/20 0.35
THRB P10828 1/20 0.35
DDB1 Q16531 1/20 0.35
CRBN Q96SW2 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
SCHEMBL18297062 1.00 USP2 (0.39) USP2SMN1; SMN2ESR2ADORA1NR1H2
SCHEMBL18280999 1.00 USP2 (0.39) USP2SMN1; SMN2ESR2ADORA1NR1H2
SCHEMBL18296909 0.86 ESR2 (0.37) USP2SMN1; SMN2ESR2ADORA1NR1H2
SCHEMBL18281013 0.86 ESR2 (0.37) USP2SMN1; SMN2ESR2ADORA1NR1H2
SCHEMBL18281014 0.86 ESR2 (0.37) USP2SMN1; SMN2ESR2ADORA1NR1H2
SCHEMBL15227284 0.83 ADORA1 (0.41) USP2SMN1; SMN2ESR2ADORA1NR1H2
SCHEMBL15227281 0.83 ADORA1 (0.41) USP2SMN1; SMN2ESR2ADORA1NR1H2
SCHEMBL518157 0.80 USP2 (0.42) USP2SMN1; SMN2ESR2ADORA1NR1H2
SCHEMBL23069031 0.79 MEN1 (0.45) GPR119KDM4E
SCHEMBL23069032 0.79 MEN1 (0.45) GPR119KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220024937-A1 3,3-DIFLUOROPIPERIDINE CARBAMATE HETEROCYCLIC COMPOUNDS AS NR2B NMDA RECEPTOR ANTAGONISTS RUGEN HOLDINGS (CAYMAN) LIMITED (KY) 2022-01-27 US disclosed
US-11136328-B2 3,3-difluoropiperidine carbamate heterocyclic compounds as NR2B NMDA receptor antagonists RUGEN HOLDINGS (CAYMAN) LIMITED (KY) 2021-10-05 US disclosed
US-20200299300-A1 3,3-DIFLUOROPIPERIDINE CARBAMATE HETEROCYCLIC COMPOUNDS AS NR2B NMDA RECEPTOR ANTAGONISTS RUGEN HOLDINGS (CAYMAN) LIMITED (KY) 2020-09-24 US disclosed
US-10584127-B2 3,3-difluoropiperidine carbamate heterocyclic compounds as NR2B NMDA receptor antagonists RUGEN HOLDINGS (CAYMAN) LIMITED (BM) 2020-03-10 US disclosed
US-10294230-B2 3,3-difluoropiperidine carbamate heterocyclic compounds as NR2B NMDA receptor antagonists RUGEN HOLDINGS (CAYMAN) LIMITED (KY) 2019-05-21 US disclosed
US-20180346476-A1 3,3-DIFLUOROPIPERIDINE CARBAMATE HETEROCYCLIC COMPOUNDS AS NR2B NMDA RECEPTOR ANTAGONISTS RUGEN HOLDINGS (CAYMAN) LIMITED (KY) 2018-12-06 US disclosed
US-20180170935-A1 3,3-DIFLUOROPIPERIDINE CARBAMATE HETEROCYCLIC COMPOUNDS AS NR2B NMDA RECEPTOR ANTAGONISTS RUGEN HOLDINGS (CAYMAN) LIMITED (KY) 2018-06-21 US disclosed
EP-3303323-A1 3,3-DIFLUOROPIPERIDINE CARBAMATE HETEROCYCLIC COMPOUNDS AS NR2B NMDA RECEPTOR ANTAGONISTS Rugen Holdings (Cayman) Limited (KY) 2018-04-11 EP disclosed
WO-2016196513-A1 3,3-DIFLUOROPIPERIDINE CARBAMATE HETEROCYCLIC COMPOUNDS AS NR2B NMDA RECEPTOR ANTAGONISTS RUGEN HOLDINGS (CAYMAN) LIMITED (KY) 2016-12-08 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 (7 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-20200299300-A1 3,3-DIFLUOROPIPERIDINE CARBAMATE HETEROCYCLIC COMPOUNDS AS NR2B NMDA RECEPTOR ANTAGONISTS GRIN3A, GRIN1, GRIN2A USP2 3896/4885SMN1; SMN2 2666/4885ESR2 331/4885
US-20180170935-A1 3,3-DIFLUOROPIPERIDINE CARBAMATE HETEROCYCLIC COMPOUNDS AS NR2B NMDA RECEPTOR ANTAGONISTS GRIN3A, GRIN1, GRIN2A USP2 3896/4885SMN1; SMN2 2666/4885ESR2 331/4885
US-20180346476-A1 3,3-DIFLUOROPIPERIDINE CARBAMATE HETEROCYCLIC COMPOUNDS AS NR2B NMDA RECEPTOR ANTAGONISTS GRIN3A, GRIN1, GRIN2A USP2 3914/4885SMN1; SMN2 2635/4885ESR2 319/4885
US-10294230-B2 3,3-difluoropiperidine carbamate heterocyclic compounds as NR2B NMDA receptor antagonists GRIN3A, GRIN1, GRIN2A USP2 3914/4885SMN1; SMN2 2635/4885ESR2 319/4885
US-20220024937-A1 3,3-DIFLUOROPIPERIDINE CARBAMATE HETEROCYCLIC COMPOUNDS AS NR2B NMDA RECEPTOR ANTAGONISTS GRIN3A, GRIN1, GRIN2A USP2 3896/4885SMN1; SMN2 2666/4885ESR2 331/4885
US-11136328-B2 3,3-difluoropiperidine carbamate heterocyclic compounds as NR2B NMDA receptor antagonists GRIN3A, GRIN1, GRIN2A USP2 3896/4885SMN1; SMN2 2666/4885ESR2 331/4885
US-10584127-B2 3,3-difluoropiperidine carbamate heterocyclic compounds as NR2B NMDA receptor antagonists GRIN3A, GRIN1, GRIN2A USP2 3896/4885SMN1; SMN2 2666/4885ESR2 331/4885

“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.