SCHEMBL179353

SCHEMBL179353

CC(=O)N1CCC(C(C)(C)C)CC1

nearest known ligand 0.66

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 6/20 0.66
CYP2D6 P10635 1/20 0.55
KCNH2 Q12809 1/20 0.55
HRH3 Q9Y5N1 1/20 0.55
CYP1A2 P05177 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
EPHX1 P07099 2/20 0.44
HSD11B1 P28845 1/20 0.43
KDM4E B2RXH2 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
QDPR P09417 1/20 0.40
LYPLA1 O75608 1/20 0.38
LYPLA2 O95372 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
RXRA P19793 1/20 0.38
RXRB P28702 1/20 0.38
RXRG P48443 1/20 0.38

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
SCHEMBL13225910 0.92 EPHX2 (0.58) EPHX2CYP2D6KCNH2HRH3CYP1A2
SCHEMBL12606929 0.89 EPHX2 (0.55) EPHX2CYP2D6KCNH2HRH3EPHX1
SCHEMBL12384517 0.87 EPHX2 (0.53) EPHX2CYP2D6KCNH2HRH3CYP1A2
SCHEMBL1104706 0.87 EPHX2 (0.53) EPHX2CYP2D6KCNH2HRH3CYP1A2
SCHEMBL25018493 0.87 EPHX2 (0.57) EPHX2CYP2D6KCNH2HRH3CYP1A2
SCHEMBL10292648 0.84 EPHX2 (0.50) EPHX2CYP2D6KCNH2HRH3CYP1A2
SCHEMBL17281941 0.84 EPHX2 (0.51) EPHX2CYP2D6KCNH2HRH3HSD11B1
SCHEMBL17471118 0.84 EPHX2 (0.72) EPHX2CYP2D6KCNH2HRH3EPHX1
SCHEMBL12384667 0.83 EPHX2 (0.77) EPHX2CYP2D6KCNH2HRH3EPHX1
SCHEMBL26783941 0.83 EPHX2 (0.49) EPHX2CYP2D6KCNH2HRH3CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240239809-A1 THERAPEUTIC AGENTS FOR ENHANCING EPITHELIAL AND/OR ENDOTHELIAL BARRIER FUNCTION ARTUS THERAPEUTICS INC (US) 2024-07-18 US disclosed
US-20240238296-A1 METHODS OF REGULATING BCL11A EXPRESSION AND TREATMENT OF BCL11A-MEDIATED DISORDERS FULCRUM THERAPEUTICS INC (US) 2024-07-18 US disclosed
US-20240238296-A1 METHODS OF REGULATING BCL11A EXPRESSION AND TREATMENT OF BCL11A-MEDIATED DISORDERS FULCRUM THERAPEUTICS INC (US) 2024-07-18 US disclosed
US-20240228478-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. 2024-07-11 US disclosed
US-12030883-B2 Hetero-tricyclic compounds as inhibitors of KRAS INCYTE CORPORATION (US) 2024-07-09 US disclosed
US-20240209000-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS AND METHODS INTELLIKINE LLC 2024-06-27 US disclosed
US-20240209000-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS AND METHODS INTELLIKINE LLC 2024-06-27 US disclosed
US-12018015-B2 Methods and compositions for targeting PD-L1 ALIGOS THERAPEUTICS, INC. (US) 2024-06-25 US disclosed
US-11834450-B2 Compounds having ((3-nitrophenyl)sulfonyl)acetamide as BCL-2 inhibitors Eil Therapeutics, Inc. (US) 2023-12-05 US disclosed
US-11834450-B2 Compounds having ((3-nitrophenyl)sulfonyl)acetamide as BCL-2 inhibitors Eil Therapeutics, Inc. (US) 2023-12-05 US disclosed
US-20080058327-A1 4-piperazinyl-5H-6,7-dihydrocyclopenta(d)pyrimidines; Hyperproliferative diseases such as cancer GENENTECH, INC. 2008-03-06 US disclosed
US-20080051399-A1 HYDROXYLATED AND METHOXYLATED PYRIMIDYL CYCLOPENTANES AS AKT PROTEIN KINASE INHIBITORS ARRAY BIOPHARMA INC. 2008-02-28 US disclosed
US-20080039465-A1 TRIAZOLYL PHENYL BENZENESULFONAMIDES CHEMOCENTRYX, INC. 2008-02-14 US disclosed
US-20080033002-A1 Modulators of muscarinic receptors VERTEX PHARMACEUTICALS INCORPORATED 2008-02-07 US disclosed
US-20080033002-A1 Modulators of muscarinic receptors VERTEX PHARMACEUTICALS INCORPORATED 2008-02-07 US disclosed
US-7291612-B2 Immunomodulatory compounds ACTIVE BIOTECH A.B. (SE) 2007-11-06 US disclosed
US-7291612-B2 Immunomodulatory compounds ACTIVE BIOTECH A.B. (SE) 2007-11-06 US disclosed
US-20070043045-A1 Novel high affinity thiophene-based and furan-based kinase ligands SCHERING CORPORATION 2007-02-22 US disclosed
US-20070043045-A1 Novel high affinity thiophene-based and furan-based kinase ligands SCHERING CORPORATION 2007-02-22 US disclosed
US-7160877-B2 Aliphatic nitrogen-containing 5-membered ring compound TANABE SEIYAKU CO., LTD. (JP) 2007-01-09 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 (12 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-20080058327-A1 4-piperazinyl-5H-6,7-dihydrocyclopenta(d)pyrimidines; Hyperproliferative diseases such as cancer PIK3CA, DPYD, CDK2 EPHX2 2196/4885CYP2D6 381/4885KCNH2 4528/4885
US-11834450-B2 Compounds having ((3-nitrophenyl)sulfonyl)acetamide as BCL-2 inhibitors BCL2, BCL2A1, BCL2L1 EPHX2 3405/4885CYP2D6 1586/4885KCNH2 3026/4885
US-12030883-B2 Hetero-tricyclic compounds as inhibitors of KRAS KRAS, NRAS, HRAS EPHX2 1845/4885CYP2D6 2792/4885KCNH2 4416/4885
US-20240209000-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS AND METHODS PIK3CA, PIK3CG, PIK3CD EPHX2 1000/4885CYP2D6 2650/4885KCNH2 3568/4885
US-20240238296-A1 METHODS OF REGULATING BCL11A EXPRESSION AND TREATMENT OF BCL11A-MEDIATED DISORDERS BCLAF1, EED, BCL3 EPHX2 597/4885CYP2D6 4334/4885KCNH2 4525/4885
US-20080051399-A1 HYDROXYLATED AND METHOXYLATED PYRIMIDYL CYCLOPENTANES AS AKT PROTEIN KINASE INHIBITORS AKT1, AKT2, AKT1S1 EPHX2 2203/4885CYP2D6 860/4885KCNH2 4688/4885
US-12018015-B2 Methods and compositions for targeting PD-L1 CD274, PDCD1LG2, PDCD1 EPHX2 3958/4885CYP2D6 2611/4885KCNH2 4395/4885
US-20240239809-A1 THERAPEUTIC AGENTS FOR ENHANCING EPITHELIAL AND/OR ENDOTHELIAL BARRIER FUNCTION LIPG, FABP2, EPCAM EPHX2 736/4885CYP2D6 4869/4885KCNH2 4019/4885
US-20080039465-A1 TRIAZOLYL PHENYL BENZENESULFONAMIDES CCR9, CCR2, CCR1 EPHX2 1107/4885CYP2D6 2413/4885KCNH2 4333/4885
US-20080033002-A1 Modulators of muscarinic receptors CHRM3, CHRM5, CHRM2 EPHX2 1111/4885CYP2D6 1646/4885KCNH2 571/4885
US-20070043045-A1 Novel high affinity thiophene-based and furan-based kinase ligands CDKL2, CDK2, CDKL1 EPHX2 1798/4885CYP2D6 3058/4885KCNH2 3469/4885
US-20240228478-A1 COMPOUNDS AND METHODS OF USE F12, C1R, ABCG2 EPHX2 1253/4885CYP2D6 33/4885KCNH2 1114/4885

“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.