SCHEMBL968488

SCHEMBL968488

CCNC(=O)N1CCOCC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 1.00
KMT2A Q03164 3/20 0.72
SMN1; SMN2 Q16637 3/20 0.53
PKM P14618 1/20 0.53
TSHR P16473 1/20 0.50
MEN1 O00255 2/20 0.47
CAPN1 P07384 1/20 0.47
RECQL P46063 1/20 0.46
CHRM1 P11229 1/20 0.46
NOS3 P29474 1/20 0.46
NOS1 P29475 1/20 0.46
GAA P10253 1/20 0.46
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45

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
SCHEMBL21896904 0.88 HTT (0.79) HTTKMT2ASMN1; SMN2PKMTSHR
SCHEMBL2760109 0.84 HTT (0.77) HTTKMT2ASMN1; SMN2PKMTSHR
SCHEMBL5020904 0.81 HTT (0.97) HTTKMT2ASMN1; SMN2PKMTSHR
SCHEMBL27570688 0.81 HTT (0.68) HTTKMT2ASMN1; SMN2PKMMEN1
SCHEMBL19741751 0.80
SCHEMBL965286 0.80 KMT2A (0.82) HTTKMT2ACHRM1NPC1RAB9A
SCHEMBL6039545 0.80 HTT (0.67) HTTKMT2ASMN1; SMN2PKMTSHR
SCHEMBL1753844 0.80 HTT (0.87) HTTKMT2ASMN1; SMN2PKMTSHR
SCHEMBL1233491 0.79 HTT (0.66) HTTKMT2ASMN1; SMN2PKMMEN1
SCHEMBL47346 0.79 HTT (0.66) HTTKMT2ASMN1; SMN2PKMMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117263952-A Condensed-cyclic compound, preparation method and application thereof 四川科伦博泰生物医药股份有限公司 2023-12-22 CN disclosed
CN-111836814-B Condensed-cyclic compound, preparation method and application thereof 四川科伦博泰生物医药股份有限公司 2023-10-20 CN disclosed
US-20230242543-A1 CDK Inhibitors And Their Use As Pharmaceuticals PRELUDE THERAPEUTICS INCORPORATED 2023-08-03 US disclosed
US-11673893-B2 CDK inhibitors and their use as pharmaceuticals PRELUDE THERAPEUTICS INCORPORATED (US) 2023-06-13 US disclosed
US-20230144528-A1 CDK Inhibitors And Their Use As Pharmaceuticals PRELUDE THERAPEUTICS, INCORPORATED 2023-05-11 US disclosed
WO-2023056441-A1 CDK INHIBITORS AND THEIR USE AS PHARMACEUTICALS PRELUDE THERAPEUTICS INCORPORATED (US) 2023-04-06 WO disclosed
WO-2021050824-A1 CDK INHIBITORS AND THEIR USE AS PHARMACEUTICALS PRELUDE THERAPEUTICS INCORPORATED (US) 2021-03-18 WO disclosed
US-20210070761-A1 CDK INHIBITORS AND THEIR USE AS PHARMACEUTICALS PRELUDE THERAPEUTICS INCORPORATED 2021-03-11 US disclosed
US-20200123132-A1 ANTIVIRAL COMPOUNDS GILEAD PHARMASSET LLC 2020-04-23 US disclosed
EP-2128139-B1 FLUORINE-CONTAINING PYRAZOLECARBONITRILE DERIVATIVE AND METHOD FOR PRODUCING THE SAME, AND FLUORINE-CONTAINING PYRAZOLECARBOXYLIC ACID DERIVATIVE OBTAINED BY USING THE FLUORINE-CONTAINING PYRAZOLECARBONITRILE DERIVATIVE AND METHOD FOR PRODUCING THE SAME MITSUI CHEMICALS AGRO INC (JP) 2013-08-07 EP disclosed
US-6541476-B1 Treating multiple sclerosis or encephalomyelitis in a human SCHERING AKTIENGESELLSCHAFT (DE) 2003-04-01 US disclosed
US-6534509-B1 Derivatives are useful as anti-inflammatory agents. This invention is also directed to pharmacetutical compostions for inflammation SCHERING AKTIENGESELLSCHAFT (DE) 2003-03-18 US disclosed
EP-0988292-B1 PIPERAZINE DERIVATIVES AND THEIR USE AS ANTI-INFLAMMATORY AGENTS SCHERING AG (DE) 2003-02-12 EP disclosed
US-20020177598-A1 Piperazine derivatives and their use as anti-inflammatory agents SCHERING AKTIENGSCHELLSCHAFT 2002-11-28 US disclosed
EP-1254899-A2 Piperazine derivatives and their use as anti-inflammatory agents Schering Aktiengesellschaft (DE) 2002-11-06 EP disclosed
US-6207665-B1 TO TREAT INFLAMMATORY DISORDERS IN HUMANS SCHERING AKTIENGESELLSCHAFT (DE) 2001-03-27 US disclosed
EP-0988292-A2 PIPERAZINE DERIVATIVES AND THEIR USE AS ANTI-INFLAMMATORY AGENTS SCHERING AKTIENGESELLSCHAFT (DE) 2000-03-29 EP disclosed
US-5864043-A CARDIOVASCULAR DISORDERS AND ANGIOTENSIN ANTAGONIST KARL THOMAE GMBH (DE) 1999-01-26 US disclosed
WO-1998056771-A2 PIPERAZINE DERIVATIVES AND THEIR USE AS ANTI-INFLAMMATORY AGENTS SCHERING AKTIENGESELLSCHAFT (DE) 1998-12-17 WO disclosed
US-5541229-A ANGIOITENSIN II ANTAGONIST AS HYPOTENSIVE AGENTS, ANTIISCHEMIC AGENTS AND CARDIOVASCULAR DISORDERS DR. KARL THOMAE GMBH (DE) 1996-07-30 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 (6 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-11673893-B2 CDK inhibitors and their use as pharmaceuticals CDK6, CDK3, CDK9 HTT 2933/4885KMT2A 282/4885SMN1; SMN2 1821/4885
US-20230144528-A1 CDK Inhibitors And Their Use As Pharmaceuticals CDK6, CDK3, CDK9 HTT 2933/4885KMT2A 282/4885SMN1; SMN2 1821/4885
US-20020177598-A1 Piperazine derivatives and their use as anti-inflammatory agents IL5, PTGES2, PTGES HTT 1362/4885KMT2A 2116/4885SMN1; SMN2 4729/4885
US-20230242543-A1 CDK Inhibitors And Their Use As Pharmaceuticals CDK6, CDK3, CDK9 HTT 2933/4885KMT2A 282/4885SMN1; SMN2 1821/4885
US-20200123132-A1 ANTIVIRAL COMPOUNDS MAVS, EIF2AK2, ZC3HAV1 HTT 1294/4885KMT2A 3803/4885SMN1; SMN2 1564/4885
US-20210070761-A1 CDK INHIBITORS AND THEIR USE AS PHARMACEUTICALS CDK6, CDK3, CDK9 HTT 2933/4885KMT2A 282/4885SMN1; SMN2 1821/4885

“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.