SCHEMBL2145085

SCHEMBL2145085

CC(C)(C)NC(=O)OC1CCC(N)CC1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.37
DPP4 P27487 2/20 0.35
CCNE1 P24864 12/20 0.34
CDK2 P24941 12/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
GSK3B P49841 7/20 0.33
SMYD3 Q9H7B4 1/20 0.33
APOBEC3A P31941 1/20 0.33
APOBEC3G Q9HC16 1/20 0.33

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
SCHEMBL16224064 1.00 EPHX1 (0.37) EPHX1DPP4CCNE1CDK2SMN1; SMN2
SCHEMBL2145078 1.00 EPHX1 (0.37) EPHX1DPP4CCNE1CDK2SMN1; SMN2
SCHEMBL25270786 0.93 EPHX1 (0.40) EPHX1DPP4CCNE1CDK2SMN1; SMN2
SCHEMBL27855976 0.91 NAAA (0.35) EPHX1DPP4CCNE1CDK2GSK3B
SCHEMBL7815595 0.90 EPHX1 (0.42) EPHX1DPP4CCNE1CDK2SMN1; SMN2
SCHEMBL23437012 0.89 EPHX1 (0.42) EPHX1DPP4SMN1; SMN2APOBEC3AAPOBEC3G
SCHEMBL25281021 0.89 CCNE1 (0.37) DPP4CCNE1CDK2GSK3B
SCHEMBL25271862 0.89 CCNE1 (0.37) DPP4CCNE1CDK2GSK3B
SCHEMBL27760444 0.89 CCNE1 (0.37) DPP4CCNE1CDK2GSK3B
Methane SCHEMBL27968861 0.88 EPHX1 (0.41) EPHX1DPP4CCNE1CDK2SMN1; SMN2

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 72 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118076581-A Iron death modulators, their preparation and use 维泰瑞隆有限公司 2024-05-24 CN disclosed
WO-2020216378-A1 HETEROCYCLIC COMPOUND, APPLICATION THEREOF, AND COMPOSITION CONTAINING SAME 健艾仕生物医药有限公司 2020-10-29 WO disclosed
CN-107200749-B DNA-PK inhibitor 沃泰克斯药物股份有限公司 2019-09-03 CN disclosed
CN-109966294-A Apoptosis-inducing agents for the treatment of cancer and immune and autoimmune diseases 艾伯维爱尔兰无限公司 2019-07-05 CN disclosed
CN-109897038-A Apoptosis-inducing agents for the treatment of cancer and immune and autoimmune diseases 艾伯维爱尔兰无限公司 2019-06-18 CN disclosed
US-10273242-B2 Compound inhibiting activities of BTK and/or JAK3 kinases Beijing Hanmi Pharmaceutical Co., Ltd. (CN) 2019-04-30 US disclosed
CN-109180702-A A kind of Thienopyrimidine ketone compound and application thereof 四川大学 2019-01-11 CN disclosed
CN-108473471-A Substituted thiourocystine derivatives as androgen receptor antagonists 詹森药业有限公司 2018-08-31 CN disclosed
US-20180051036-A1 COMPOUND INHIBITING ACTIVITIES OF BTK AND/OR JAK3 KINASES Beijing Hanmi Pharmaceutical Co., Ltd. (CN) 2018-02-22 US disclosed
US-9840517-B2 Compound inhibiting activities of BTK and/or JAK3 kinases Beijing Hanmi Pharmaceutical Co., Ltd. (CN) 2017-12-12 US disclosed
CN-1829712-A Nicotinamide derivatives useful as PDE4 inhibitors PFIZER (US) 2006-09-06 CN disclosed
CN-1652782-A Nicotinamide derivatives useful as PDE4 inhibitors PFIZER (US) 2005-08-10 CN disclosed
CN-1582281-A MCH receptor antagonists TAISHO PHARMACEUTICAL CO LTD (JP) 2005-02-16 CN disclosed
CN-1578779-A Small organic molecule regulators of cell proliferation CURIS INC (US) 2005-02-09 CN disclosed
US-6096751-A INSECTICIDES, PARASITICIDES BAYER AKTIENGESELLSCHAFT (DE) 2000-08-01 US disclosed
US-6054459-A INSECTICIDES AND ECTOPARASITICIDES BAYER AKTIENGESELLSCHAFT (DE) 2000-04-25 US disclosed
EP-0740666-B1 SUBSTITUTED 1,2,3,4-TETRAHYDRO-5-NITRO PYRIMIDINES BAYER AG (DE) 1999-11-10 EP disclosed
US-5869491-A PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1999-02-09 US disclosed
EP-0740666-A1 SUBSTITUTED 1,2,3,4-TETRAHYDRO-5-NITRO PYRIMIDINES BAYER AG (DE) 1996-11-06 EP disclosed
WO-1995019977-A1 SUBSTITUTED 1,2,3,4-TETRAHYDRO-5-NITRO PYRIMIDINES BAYER AKTIENGESELLSCHAFT (DE) 1995-07-27 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-20180051036-A1 COMPOUND INHIBITING ACTIVITIES OF BTK AND/OR JAK3 KINASES BTK, JAK3, JAK2 EPHX1 3827/4885DPP4 2607/4885CCNE1 3090/4885
US-10273242-B2 Compound inhibiting activities of BTK and/or JAK3 kinases BTK, JAK3, JAK2 EPHX1 3827/4885DPP4 2607/4885CCNE1 3090/4885

“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.