SCHEMBL3492072

SCHEMBL3492072

CC(C)(C)OC(=O)N1CCN(Cc2ccccc2)C(CN)C1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 2/20 0.50
OPRD1 P41143 1/20 0.48
OPRK1 P41145 1/20 0.48
JAK2 O60674 1/20 0.47
JAK1 P23458 1/20 0.47
CA1 P00915 4/20 0.46
CA2 P00918 4/20 0.46
CA4 P22748 4/20 0.46
CA9 Q16790 4/20 0.46
STS P08842 1/20 0.45
ALDH1A1 P00352 1/20 0.44
BRD4 O60885 1/20 0.43
BCHE P06276 1/20 0.43
HTR6 P50406 1/20 0.43
ABHD6 Q9BV23 1/20 0.43
DAGLA Q9Y4D2 1/20 0.43
USP30 Q70CQ3 2/20 0.43
PARP1 P09874 1/20 0.42
KDM4E B2RXH2 1/20 0.42
PKM P14618 1/20 0.42

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
SCHEMBL2062670 1.00 GPR119 (0.50) GPR119OPRD1OPRK1JAK2JAK1
SCHEMBL25021630 0.89 GPR119 (0.51) GPR119OPRD1OPRK1JAK2JAK1
SCHEMBL21005361 0.89 SIGMAR1 (0.52) GPR119OPRD1OPRK1JAK2JAK1
SCHEMBL2063154 0.89 SIGMAR1 (0.52) GPR119OPRD1OPRK1JAK2JAK1
SCHEMBL2063153 0.89 SIGMAR1 (0.52) GPR119OPRD1OPRK1JAK2JAK1
SCHEMBL26891185 0.89 GPR119 (0.51) GPR119OPRD1OPRK1JAK2JAK1
SCHEMBL10842344 0.89 GPR119 (0.51) GPR119OPRD1OPRK1JAK2JAK1
SCHEMBL25532990 0.88 GPR119 (0.47) GPR119OPRD1OPRK1JAK2JAK1
SCHEMBL29247571 0.88 GPR119 (0.47) GPR119OPRD1OPRK1JAK2JAK1
SCHEMBL13705079 0.88 GPR119 (0.47) GPR119OPRD1OPRK1JAK2JAK1

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
US-20230165865-A1 HETEROARYLDIHYDROPYRIMIDINE DERIVATIVES AND METHODS OF TREATING HEPATITIS B INFECTIONS JANSSEN PHARMACEUTICA NV (BE) 2023-06-01 US disclosed
CN-113195499-A Heteroaryl dihydropyrimidine derivatives and methods for treating hepatitis b infection 詹森药业有限公司 2021-07-30 CN disclosed
US-20100105665-A1 RENIN INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-04-29 US disclosed
WO-2008089005-A2 RENIN INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-07-24 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-20100105665-A1 RENIN INHIBITORS REN, ACE, AGT GPR119 610/4885OPRD1 1678/4885OPRK1 888/4885
US-20230165865-A1 HETEROARYLDIHYDROPYRIMIDINE DERIVATIVES AND METHODS OF TREATING HEPATITIS B INFECTIONS HAVCR2, HCCS, PYGL GPR119 3102/4885OPRD1 3588/4885OPRK1 3645/4885

“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.