SCHEMBL1911533

SCHEMBL1911533

CC(C)C(=O)N(C)C1CCOCC1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 3/20 0.47
DPP4 P27487 1/20 0.39
DPP9 Q86TI2 1/20 0.39
HSD11B1 P28845 1/20 0.35
KDM4E B2RXH2 2/20 0.33
BCL2A1 Q16548 1/20 0.33
CCR5 P51681 1/20 0.33
KMT2A Q03164 4/20 0.32
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
LIPE Q05469 1/20 0.32
MEN1 O00255 2/20 0.32
MAPT P10636 1/20 0.32
PYGL P06737 1/20 0.32
MCHR1 Q99705 1/20 0.31

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
SCHEMBL16219004 0.89 PIK3CD (0.41) PIK3CDDPP4DPP9HSD11B1CCR5
SCHEMBL16219008 0.85 DPP4 (0.47) DPP4DPP9CCR5LIPE
SCHEMBL18907363 0.83 DPP4 (0.42) DPP4DPP9CCR5NPC1RAB9A
SCHEMBL18425770 0.82 PIK3CD (0.46) PIK3CDHSD11B1KDM4ECCR5KMT2A
SCHEMBL12304280 0.81 ADH1C (0.42) DPP4DPP9CCR5NPC1RAB9A
SCHEMBL19702055 0.80 PIK3CD (0.47) PIK3CD
SCHEMBL12308324 0.79 ADH1C (0.45) DPP4DPP9NPC1RAB9ALIPE
SCHEMBL16219007 0.79 DPP4 (0.35) PIK3CDDPP4DPP9
SCHEMBL24313163 0.78 PIK3CD (0.38) PIK3CDDPP4DPP9HSD11B1CCR5
SCHEMBL18421370 0.78 PIK3CD (0.46) PIK3CDDPP4DPP9HSD11B1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11834433-B2 Compounds INFLAZOME LIMITED (IE) 2023-12-05 US disclosed
US-20230339934-A1 PYRIMIDIN-4(3H)-ONE DERIVATIVES AS TRPV4 ANTAGONISTS RAQUALIA PHARMA INC. (JP) 2023-10-26 US disclosed
US-20230339934-A1 PYRIMIDIN-4(3H)-ONE DERIVATIVES AS TRPV4 ANTAGONISTS RAQUALIA PHARMA INC. (JP) 2023-10-26 US disclosed
US-20230255965-A1 TRPV4 INHIBITOR AS A THERAPEUTIC AGENT FOR OCULAR DISEASES RAQUALIA PHARMA INC. (JP) 2023-08-17 US disclosed
US-20230150993-A1 ANTIPROLIFERATION COMPOUNDS AND USES THEREOF VERTEX PHARMACEUTICALS INCORPORATED 2023-05-18 US disclosed
US-20230150993-A1 ANTIPROLIFERATION COMPOUNDS AND USES THEREOF VERTEX PHARMACEUTICALS INCORPORATED 2023-05-18 US disclosed
US-20230130516-A1 1H-PYRAZOLO[4,3-d]PYRIMIDINE COMPOUNDS AS TOLL-LIKE RECEPTOR 7 (TLR7) AGONISTS BRISTOL-MYERS SQUIBB COMPANY 2023-04-27 US disclosed
US-20230130516-A1 1H-PYRAZOLO[4,3-d]PYRIMIDINE COMPOUNDS AS TOLL-LIKE RECEPTOR 7 (TLR7) AGONISTS BRISTOL-MYERS SQUIBB COMPANY 2023-04-27 US disclosed
US-11542255-B2 Sulfonylureas and sulfonylthioureas as NLRP3 inhibitors INFLAZOME LIMITED (IE) 2023-01-03 US disclosed
EP-3784666-B1 ANTIPROLIFERATION COMPOUNDS AND USES THEREOF MERCK PATENT GMBH (DE) 2022-03-16 EP disclosed
US-10815225-B2 Antiproliferation compounds and uses thereof MERCK PATENT GMBH (DE) 2020-10-27 US disclosed
US-20200317637-A1 NOVEL SULFONAMIDE CARBOXAMIDE COMPOUNDS INFLAZOME LIMITED (IE) 2020-10-08 US disclosed
US-20190322658-A1 ANTIPROLIFERATION COMPOUNDS AND USES THEREOF MERCK PATENT GMBH (DE) 2019-10-24 US disclosed
US-20170280720-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2017-10-05 US disclosed
US-20170280720-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2017-10-05 US disclosed
US-9018224-B2 Substituted cyclopropyl compounds useful as GPR119 agonists MERCK SHARP & DOHME CORP. (US) 2015-04-28 US disclosed
US-20140329798-A1 SUBSTITUTED CYCLOPROPYL COMPOUNDS USEFUL AS GPR119 AGONISTS MERCK SHARP & DOHME LLC 2014-11-06 US disclosed
US-20120077787-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2012-03-29 US disclosed
US-8097617-B2 Organic compounds NOVARTIS AG (CH) 2012-01-17 US disclosed
US-20090253689-A1 Organic Compounds NOVARTIS AG (CH) 2009-10-08 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 (13 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-20120077787-A1 ORGANIC COMPOUNDS OAT, GPR119, OTC PIK3CD 2458/4885DPP4 120/4885DPP9 380/4885
US-20190322658-A1 ANTIPROLIFERATION COMPOUNDS AND USES THEREOF MKI67, MCL1, CCNI PIK3CD 1381/4885DPP4 2909/4885DPP9 2543/4885
US-20170280720-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF PRMT1, PRMT3, PRMT5 PIK3CD 3639/4885DPP4 1543/4885DPP9 488/4885
US-20230130516-A1 1H-PYRAZOLO[4,3-d]PYRIMIDINE COMPOUNDS AS TOLL-LIKE RECEPTOR 7 (TLR7) AGONISTS TLR7, TLR1, TLR9 PIK3CD 1225/4885DPP4 936/4885DPP9 700/4885
US-20200317637-A1 NOVEL SULFONAMIDE CARBOXAMIDE COMPOUNDS NLRP3, NOD1, PYCARD PIK3CD 2862/4885DPP4 8/4885DPP9 74/4885
US-11542255-B2 Sulfonylureas and sulfonylthioureas as NLRP3 inhibitors NLRP3, NOD1, PYCARD PIK3CD 3948/4885DPP4 6/4885DPP9 13/4885
US-20230150993-A1 ANTIPROLIFERATION COMPOUNDS AND USES THEREOF MKI67, MCL1, CCNI PIK3CD 1381/4885DPP4 2909/4885DPP9 2543/4885
US-20090253689-A1 Organic Compounds OAT, GPR119, OTC PIK3CD 2458/4885DPP4 120/4885DPP9 380/4885
US-11834433-B2 Compounds NLRP3, NOD1, PYCARD PIK3CD 3329/4885DPP4 269/4885DPP9 533/4885
US-20230339934-A1 PYRIMIDIN-4(3H)-ONE DERIVATIVES AS TRPV4 ANTAGONISTS TRPV4, TRPV1, TRPV2 PIK3CD 1820/4885DPP4 224/4885DPP9 1122/4885
US-10815225-B2 Antiproliferation compounds and uses thereof MKI67, MCL1, CCNI PIK3CD 1381/4885DPP4 2909/4885DPP9 2543/4885
US-20230255965-A1 TRPV4 INHIBITOR AS A THERAPEUTIC AGENT FOR OCULAR DISEASES TRPV4, TRPV5, TRPV2 PIK3CD 500/4885DPP4 393/4885DPP9 769/4885
US-20140329798-A1 SUBSTITUTED CYCLOPROPYL COMPOUNDS USEFUL AS GPR119 AGONISTS GPR119, GPR27, GCGR PIK3CD 2348/4885DPP4 620/4885DPP9 380/4885

“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.