SCHEMBL5543091

SCHEMBL5543091

CN(C(=O)C(C)(C)C)C(C)(C)C

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 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
SCHEMBL22868175 0.77 RIPK1 (0.31)
SCHEMBL11655814 0.77
SCHEMBL20063361 0.77
SCHEMBL24256512 0.77 CHRM2 (0.34)
SCHEMBL17854740 0.77 MEN1 (0.30) MEN1CYP3A4CYP2C9CYP2C19KMT2A
SCHEMBL24507340 0.77
SCHEMBL1106444 0.76
SCHEMBL19091449 0.73 MEN1 (0.34) MEN1CYP3A4CYP2C9CYP2C19KMT2A
SCHEMBL16944043 0.73 ALDH1A1 (0.39) MEN1CYP3A4CYP2C9CYP2C19KMT2A
SCHEMBL12591096 0.73 ALDH1A1 (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11834413-B2 Antiplatelet drugs and uses thereof SHANGHAI CUREGENE PHARMACEUTICAL CO LTD. (CN) 2023-12-05 US disclosed
US-20230357199-A1 ARYL, HETEROARYL, AND HETEROCYCLIC PHARMACEUTICAL COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS ACHILLION PHARMACEUTICALS, INC. 2023-11-09 US disclosed
US-20230302091-A1 Combination Therapy with Controlled-Release CNP Agonists ASCENDIS PHARMA GROWTH DISORDERS AS (DK) 2023-09-28 US disclosed
US-20230295089-A1 ANTIPLATELET DRUGS AND USES THEREOF SHANGHAI CUREGENE PHARMACEUTICAL CO., LTD. (CN) 2023-09-21 US disclosed
US-20230255950-A1 3-(Hydroxy)-Pyridin-4(1H)-One Compounds and Methods of Making and Using the Same GEORGIA TECH RESEARCH CORPORATION 2023-08-17 US disclosed
US-20230255950-A1 3-(Hydroxy)-Pyridin-4(1H)-One Compounds and Methods of Making and Using the Same GEORGIA TECH RESEARCH CORPORATION 2023-08-17 US disclosed
US-20230250089-A1 MAP4K3 SMALL MOLECULE DRUG INHIBITORS AND METHODS OF USE THEREOF NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2023-08-10 US disclosed
US-11718626-B2 Macrocyclic compounds for treatment of medical disorders ACHILLION PHARMACEUTICALS, INC. (US) 2023-08-08 US disclosed
US-11708351-B2 Aryl, heteroaryl, and heterocyclic pharmaceutical compounds for treatment of medical disorders ACHILLION PHARMACEUTICALS, INC. (US) 2023-07-25 US disclosed
US-11667613-B2 Antiviral pyrazolopyridinone compounds NOVARTIS AG (CH) 2023-06-06 US disclosed
US-20120115864-A1 Substituted Fused Pyrimidine Compounds ADVINUS THERAPEUTICS LIMITED (IN) 2012-05-10 US disclosed
US-20110224208-A1 NOVEL INHIBITORS OF FLAVIVIRUS REPLICATION KATHOLIEKE UNIVERSITEIT LEUVEN, K.U. LEUVEN R&D (BE) 2011-09-15 US disclosed
US-7947708-B2 Compounds modulating C-kit activity PLEXXIKON, INC. (US) 2011-05-24 US disclosed
US-20110077237-A1 KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-03-31 US disclosed
US-20100286390-A1 PYRIDAZINONE COMPOUNDS AND P2X7 RECEPTOR INHIBITORS NISSAN CHEMICAL INDUSTRIES LIMITED 2010-11-11 US disclosed
US-20090264496-A1 Compounds, Compositions and Methods for Making the Same SIGNUM BIOSCIENCES, INC. 2009-10-22 US disclosed
US-20090124602-A1 KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED 2009-05-14 US disclosed
US-7494714-B2 Surfaces that resist the adsorption of biological species PRESIDENT & FELLOWS OF HARVARD COLLEGE (US) 2009-02-24 US disclosed
US-20070264505-A1 Resistant to the adsorption of proteins, cells and bacteria; have a chemical chain bonded thereon that comprise a terminal group free of a hydrogen bond donor or where a hydrogen bond donor is sufficiently buried PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2007-11-15 US disclosed
US-7276286-B2 Surfaces that resist the adsorption of biological species PRESIDENT & FELLOWS OF HARVARD COLLEGE (US) 2007-10-02 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 (15 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-20230255950-A1 3-(Hydroxy)-Pyridin-4(1H)-One Compounds and Methods of Making and Using the Same KDM1B, KDM3A, KDM1A MEN1 1552/4885CYP3A4 2183/4885CYP2C9 3689/4885
US-20090264496-A1 Compounds, Compositions and Methods for Making the Same PPP2CA, PPP4C, PPP6C MEN1 3072/4885CYP3A4 3267/4885CYP2C9 4067/4885
US-20090124602-A1 KINASE INHIBITORS MAP3K20, MAP3K1, MAP3K6 MEN1 1427/4885CYP3A4 3450/4885CYP2C9 3533/4885
US-11718626-B2 Macrocyclic compounds for treatment of medical disorders CFD, TFPI, CFH MEN1 139/4885CYP3A4 263/4885CYP2C9 210/4885
US-11708351-B2 Aryl, heteroaryl, and heterocyclic pharmaceutical compounds for treatment of medical disorders CFD, TFPI, CFH MEN1 1035/4885CYP3A4 57/4885CYP2C9 51/4885
US-11834413-B2 Antiplatelet drugs and uses thereof PFKP, GP6, PF4 MEN1 2835/4885CYP3A4 2072/4885CYP2C9 1891/4885
US-20230357199-A1 ARYL, HETEROARYL, AND HETEROCYCLIC PHARMACEUTICAL COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS CFD, TFPI, CFH MEN1 1035/4885CYP3A4 57/4885CYP2C9 51/4885
US-20230250089-A1 MAP4K3 SMALL MOLECULE DRUG INHIBITORS AND METHODS OF USE THEREOF MAP4K3, MAP3K4, MAP3K3 MEN1 2811/4885CYP3A4 2493/4885CYP2C9 4601/4885
US-20110224208-A1 NOVEL INHIBITORS OF FLAVIVIRUS REPLICATION MAVS, IRF3, EIF2AK2 MEN1 4759/4885CYP3A4 722/4885CYP2C9 2412/4885
US-20100286390-A1 PYRIDAZINONE COMPOUNDS AND P2X7 RECEPTOR INHIBITORS P2RY1, P2RX7, P2RX1 MEN1 3931/4885CYP3A4 830/4885CYP2C9 1174/4885
US-20230295089-A1 ANTIPLATELET DRUGS AND USES THEREOF PFKP, GP6, PF4 MEN1 2835/4885CYP3A4 2072/4885CYP2C9 1891/4885
US-11667613-B2 Antiviral pyrazolopyridinone compounds ZC3HAV1, TYMP, ZC3HAV1L MEN1 1512/4885CYP3A4 198/4885CYP2C9 245/4885
US-20120115864-A1 Substituted Fused Pyrimidine Compounds ADORA2A, ADORA1, ADORA3 MEN1 4851/4885CYP3A4 1199/4885CYP2C9 2056/4885
US-20230302091-A1 Combination Therapy with Controlled-Release CNP Agonists CNP, NPR1, NGF MEN1 1072/4885CYP3A4 4769/4885CYP2C9 4681/4885
US-20110077237-A1 KINASE INHIBITORS MAP3K20, MAP3K1, MAP3K6 MEN1 1427/4885CYP3A4 3450/4885CYP2C9 3533/4885

“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.