SCHEMBL19851880

SCHEMBL19851880

CC(C)(C)OC(=O)N1CCC(CC/C=C/CO)CC1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.50
RECQL P46063 1/20 0.48
KDM4E B2RXH2 1/20 0.46
PKM P14618 1/20 0.46
GPR119 Q8TDV5 7/20 0.46
EPHX1 P07099 1/20 0.45
FAAH O00519 1/20 0.45
NR1H2 P55055 1/20 0.44
PTPN2 P17706 1/20 0.44
PTPN1 P18031 1/20 0.44
PTPN6 P29350 1/20 0.44
USP2 O75604 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL1186709 0.87 HPGD (0.48) HPGDRECQLKDM4EPKMGPR119
SCHEMBL1186705 0.87 HPGD (0.48) HPGDRECQLKDM4EPKMGPR119
SCHEMBL12873541 0.87 HPGD (0.48) HPGDRECQLKDM4EPKMGPR119
SCHEMBL1576006 0.84 HPGD (0.50) HPGDRECQLKDM4EPKMGPR119
SCHEMBL21997258 0.82 HPGD (0.49) HPGDRECQLKDM4EPKMGPR119
SCHEMBL1773494 0.82 HPGD (0.47) HPGDRECQLKDM4EPKMGPR119
SCHEMBL1773493 0.82 HPGD (0.47) HPGDRECQLKDM4EPKMGPR119
SCHEMBL22907013 0.82 HPGD (0.47) HPGDRECQLKDM4EPKMGPR119
SCHEMBL1773571 0.82 HPGD (0.47) HPGDRECQLKDM4EPKMGPR119
SCHEMBL310405 0.82 HPGD (0.54) HPGDRECQLKDM4EPKMGPR119

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-10894785-B2 Piperidine derivatives for use in the treatment of pancreatic cancer CENTRE HOSPITALIER UNIVERSITAIRE VAUDOIS CHUV 2021-01-19 US disclosed
US-20190185452-A1 PIPERIDINE DERIVATIVES FOR USE IN THE TREATMENT OF PANCREATIC CANCER CENTRE HOSPITALIER UNIVERSITAIRE VAUDOIS CHUV (CH) 2019-06-20 US disclosed
WO-2018024907-A1 PIPERIDINE DERIVATIVES FOR USE IN THE TREATMENT OF PANCREATIC CANCER CENTRE HOSPITALIER UNIVERSITAIRE VAUDOIS CHUV (CH) 2018-02-08 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 (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-10894785-B2 Piperidine derivatives for use in the treatment of pancreatic cancer RNASE1, PKD1, GPR6 HPGD 2915/4885RECQL 4260/4885KDM4E 2358/4885
US-20190185452-A1 PIPERIDINE DERIVATIVES FOR USE IN THE TREATMENT OF PANCREATIC CANCER RNASE1, PKD1, GPR6 HPGD 3004/4885RECQL 4374/4885KDM4E 1993/4885

“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.