SCHEMBL12784271

SCHEMBL12784271

CNc1c(NC(C)C)c(=O)c1=O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 1/20 0.35
PLK1 P53350 4/20 0.32
CHEK1 O14757 2/20 0.31
DAPK3 O43293 2/20 0.31
ROCK2 O75116 2/20 0.31
CHEK2 O96017 2/20 0.31
PIM1 P11309 2/20 0.31
ROCK1 Q13464 2/20 0.31
CDC42BPA Q5VT25 2/20 0.31
PLK3 Q9H4B4 2/20 0.31
GAA P10253 1/20 0.31
HSD17B10 Q99714 1/20 0.31
KDM4E B2RXH2 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
CDC7 O00311 1/20 0.31
PLK4 O00444 1/20 0.31
GSK3A P49840 1/20 0.31
GSK3B P49841 1/20 0.31
PRKX P51817 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
SCHEMBL22895152 0.89 CXCR2 (0.39) CXCR2PLK1CHEK1DAPK3ROCK2
SCHEMBL25955183 0.84 HDAC1 (0.38)
SCHEMBL25477849 0.80 CXCR2 (0.33) CXCR2PLK1
SCHEMBL409685 0.80
SCHEMBL19956914 0.75 HDAC1 (0.33)
SCHEMBL17899042 0.73 PLK1 (0.37) CXCR2PLK1CHEK1DAPK3ROCK2
SCHEMBL26546660 0.73 HTT (0.35) CXCR2PLK1CHEK1DAPK3ROCK2
SCHEMBL10209850 0.72 GAA (0.41) CXCR2GAAHSD17B10KDM4ECYP1A2
SCHEMBL17532555 0.69 POLB (0.31)
SCHEMBL19956902 0.69 KDM4E (0.38) GAAKDM4ECYP1A2CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240238212-A1 LIPID COMPOUNDS AND LIPID NANOPARTICLE COMPOSITIONS Suzhou Abogen Biosciences Co., Ltd. (CN) 2024-07-18 US disclosed
US-20240024489-A1 PROTECTED DISACCHARIDES, THEIR PROCESS OF PREPARATION AND THEIR USE IN THE SYNTHESIS OF ZWITTERIONIC OLIGOSACCHARIDES, AND CONJUGATES THEREOF INSTITUT PASTEUR (FR) 2024-01-25 US disclosed
US-11773061-B2 Cyclic lipids and methods of use thereof RENAGADE THERAPEUTICS MANAGEMENT INC. (US) 2023-10-03 US disclosed
US-11773061-B2 Cyclic lipids and methods of use thereof RENAGADE THERAPEUTICS MANAGEMENT INC. (US) 2023-10-03 US disclosed
US-20230285310-A1 COMPOSITIONS FOR THE DELIVERY OF PAYLOAD MOLECULES TO AIRWAY EPITHELIUM ARES CAPITAL CORPORATION, AS AGENT 2023-09-14 US disclosed
US-20230285310-A1 COMPOSITIONS FOR THE DELIVERY OF PAYLOAD MOLECULES TO AIRWAY EPITHELIUM ARES CAPITAL CORPORATION, AS AGENT 2023-09-14 US disclosed
US-20230242474-A1 LIPID COMPOUND AND THE COMPOSITION THEREOF GUANGZHOU RIBOBIO CO., LTD. (CN) 2023-08-03 US disclosed
US-20230242474-A1 LIPID COMPOUND AND THE COMPOSITION THEREOF GUANGZHOU RIBOBIO CO., LTD. (CN) 2023-08-03 US disclosed
US-20230202966-A1 ACYCLIC LIPIDS AND METHODS OF USE THEREOF RENAGADE THERAPEUTICS MANAGEMENT INC. 2023-06-29 US disclosed
US-20230202966-A1 ACYCLIC LIPIDS AND METHODS OF USE THEREOF RENAGADE THERAPEUTICS MANAGEMENT INC. 2023-06-29 US disclosed
WO-2023118195-A1 FAP-TARGETING PHARMACEUTICAL PRODUCT FOR THERAPY AND DIAGNOSIS OF CANCERS Atoms for Cure GmbH (DE) 2023-06-29 WO disclosed
WO-2023078271-A1 AROMATIC COMPOUND, PREPARATION METHOD THEREFOR, INTERMEDIATE THEREOF, PHARMACEUTICAL COMPOSITION THEREOF, AND USE THEREOF 上海旭成医药科技有限公司 2023-05-11 WO disclosed
US-10654808-B2 Tyrosine kinase inhibitor and pharmaceutical composition comprising same Guangdong Raynovent Biotech Co., Ltd. (CN) 2020-05-19 US disclosed
US-20190119217-A1 TYROSINE KINASE INHIBITOR AND PHARMACEUTICAL COMPOSITION COMPRISING SAME Guangdong Raynovent Biotech Co., Ltd. (CN) 2019-04-25 US disclosed
EP-3293177-A1 TYROSINE KINASE INHIBITOR AND PHARMACEUTICAL COMPOSITION COMPRISING SAME GUANGDONG ZHONGSHENG PHARMACEUTICAL CO., LTD (CN) 2018-03-14 EP disclosed
WO-2017046535-A1 MULTI-FUNCTIONALIZED POLYSACCHARIDE COMPOUNDS AND USE THEREOF FOR TARGETING THE CATION-INDEPENDENT MANNOSE 6-PHOSPHATE RECEPTOR NANOMEDSYN (FR) 2017-03-23 WO disclosed
EP-2305697-A2 Macrocyclic inhibitors of Hepatitis C virus replication Intermune, Inc. (US) 2011-04-06 EP disclosed
EP-2305698-A2 Macrocyclic inhibitors of Hepatitis C virus replication Intermune, Inc. (US) 2011-04-06 EP 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 (8 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-20190119217-A1 TYROSINE KINASE INHIBITOR AND PHARMACEUTICAL COMPOSITION COMPRISING SAME ABL1, LCK, ERBB2 CXCR2 1145/4885PLK1 131/4885CHEK1 393/4885
US-10654808-B2 Tyrosine kinase inhibitor and pharmaceutical composition comprising same ABL1, LCK, ERBB2 CXCR2 1145/4885PLK1 131/4885CHEK1 393/4885
US-20240024489-A1 PROTECTED DISACCHARIDES, THEIR PROCESS OF PREPARATION AND THEIR USE IN THE SYNTHESIS OF ZWITTERIONIC OLIGOSACCHARIDES, AND CONJUGATES THEREOF SI, DAD1, FUT5 CXCR2 2720/4885PLK1 1139/4885CHEK1 4558/4885
US-11773061-B2 Cyclic lipids and methods of use thereof SGMS1, SGMS2, LNPEP CXCR2 969/4885PLK1 1419/4885CHEK1 3061/4885
US-20230285310-A1 COMPOSITIONS FOR THE DELIVERY OF PAYLOAD MOLECULES TO AIRWAY EPITHELIUM CFTR, TSLP, MTREX CXCR2 498/4885PLK1 1356/4885CHEK1 3981/4885
US-20230242474-A1 LIPID COMPOUND AND THE COMPOSITION THEREOF NPC1L1, NPC1, SGMS1 CXCR2 995/4885PLK1 1410/4885CHEK1 4759/4885
US-20240238212-A1 LIPID COMPOUNDS AND LIPID NANOPARTICLE COMPOSITIONS CETP, NPC1, LCAT CXCR2 3450/4885PLK1 737/4885CHEK1 3525/4885
US-20230202966-A1 ACYCLIC LIPIDS AND METHODS OF USE THEREOF SGMS1, SGMS2, ABHD16A CXCR2 1803/4885PLK1 1743/4885CHEK1 3460/4885

“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.