SCHEMBL89757

SCHEMBL89757

COCC1(NC(=O)OC(C)(C)C)CC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPIA P62937 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
MAPK1 P28482 1/20 0.36
CTSL P07711 1/20 0.36
CA12 O43570 3/20 0.36
CA14 Q9ULX7 3/20 0.36
CA2 P00918 2/20 0.36
APLNR P35414 1/20 0.36
TDP1 Q9NUW8 1/20 0.35
P2RX7 Q99572 1/20 0.35
DGAT1 O75907 1/20 0.34
CA1 P00915 2/20 0.34
CA7 P43166 2/20 0.34
CTSK P43235 1/20 0.33
GAA P10253 1/20 0.33
EPHX1 P07099 1/20 0.33
NFKB1 P19838 1/20 0.32
NFKB2 Q00653 1/20 0.32
RELA Q04206 1/20 0.32

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
SCHEMBL2809077 0.93 P2RX7 (0.41) PPIAMEN1KMT2AMAPK1CTSL
SCHEMBL29420344 0.89 USP2 (0.38) PPIAMEN1KMT2AMAPK1CTSL
SCHEMBL9898935 0.89 P2RX7 (0.34) PPIAMEN1KMT2AMAPK1CTSL
SCHEMBL23161172 0.86 MEN1 (0.36) PPIAMEN1KMT2AMAPK1CTSL
SCHEMBL23663256 0.84 PPIA (0.36) PPIAMEN1KMT2AMAPK1CTSL
SCHEMBL22633505 0.83 CA12 (0.36) PPIAMEN1KMT2AMAPK1CTSL
SCHEMBL9175696 0.83 P2RX7 (0.33) PPIAMEN1KMT2AMAPK1CTSL
SCHEMBL89820 0.83 KMT2A (0.35) PPIAMEN1KMT2AMAPK1CTSL
SCHEMBL56916 0.81 TDP1 (0.41) PPIAMEN1KMT2AMAPK1CTSL
SCHEMBL14173595 0.81 KMT2A (0.38) PPIAMEN1KMT2AMAPK1CTSL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12065445-B2 CDK2 inhibitors and methods of using the same CEDILLA THERAPEUTICS, INC. (US) 2024-08-20 US disclosed
US-20240174680-A1 CDK2 INHIBITORS AND METHODS OF USING THE SAME CEDILLA THERAPEUTICS, INC. (US) 2024-05-30 US disclosed
EP-4284365-A1 CDK2 INHIBITORS AND METHODS OF USING THE SAME Cedilla Therapeutics, Inc. (US) 2023-12-06 EP disclosed
US-20230109076-A1 CDK2 INHIBITORS AND METHODS OF USING THE SAME CEDILLA THERAPEUTICS, INC. 2023-04-06 US disclosed
WO-2023011540-A1 FUSED RING COMPOUND, PHARMACEUTICAL COMPOSITION, AND APPLICATION THEREOF 苏州信诺维医药科技股份有限公司 2023-02-09 WO disclosed
WO-2022165513-A1 CDK2 INHIBITORS AND METHODS OF USING THE SAME CEDILLA THERAPEUTICS, INC. (US) 2022-08-04 WO disclosed
EP-2894151-B1 IMIDAZOLINE DERIVATIVES, PREPARATION METHODS THEREOF, AND THEIR APPLICATIONS IN MEDICINE Shanghai hengrui pharmaceutical co ltd (CN) 2020-11-11 EP disclosed
US-9895355-B2 Methods of treating androgen receptor-mediated disorders with imidazoline derivatives Shanghai Hengru Pharmaceutical Co., Ltd. (CN) 2018-02-20 US disclosed
US-20170128422-A1 METHODS OF TREATING ANDROGEN RECEPTOR-MEDIATED DISORDERS WITH IMIDAZOLINE DERIVATIVES Shanghai hengrui pharmaceutical co ltd (CN) 2017-05-11 US disclosed
US-8129411-B2 Organic compounds NOVARTIS AG (CH) 2012-03-06 US disclosed
US-8129411-B2 Organic compounds NOVARTIS AG (CH) 2012-03-06 US disclosed
EP-2420491-A1 3 , 5-substitued piperidine compounds as renin inhibitors Novartis AG (CH) 2012-02-22 EP disclosed
US-20090192148-A1 Organic Compounds NOVARTIS AG (CH) 2009-07-30 US disclosed
US-20090192148-A1 Organic Compounds NOVARTIS AG (CH) 2009-07-30 US disclosed
WO-2007077005-A1 3 , 5-SUBSTITΓUED PIPERIDINE COMPOUNDS AS RENIN INHIBITORS NOVARTIS AG (CH) 2007-07-12 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 (5 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-20240174680-A1 CDK2 INHIBITORS AND METHODS OF USING THE SAME CDK2, CDK20, CDK2AP2 PPIA 1861/4885MEN1 2265/4885KMT2A 550/4885
US-20090192148-A1 Organic Compounds REN, ACE, AGTR1 PPIA 3155/4885MEN1 2336/4885KMT2A 3129/4885
US-20230109076-A1 CDK2 INHIBITORS AND METHODS OF USING THE SAME CDK2, CDK20, CDK2AP2 PPIA 1861/4885MEN1 2265/4885KMT2A 550/4885
US-20170128422-A1 METHODS OF TREATING ANDROGEN RECEPTOR-MEDIATED DISORDERS WITH IMIDAZOLINE DERIVATIVES NR5A1, ESRRA, ESRRB PPIA 1852/4885MEN1 1221/4885KMT2A 1916/4885
US-12065445-B2 CDK2 inhibitors and methods of using the same CDK2, CDK20, CDK1 PPIA 2784/4885MEN1 1779/4885KMT2A 486/4885

“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.