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) —
SCHEMBL26546660 0.73 HTT (0.35) CXCR2PLK1CHEK1DAPK3ROCK2
SCHEMBL17899042 0.73 PLK1 (0.37) CXCR2PLK1CHEK1DAPK3ROCK2
SCHEMBL10209850 0.72 GAA (0.41) CXCR2GAAHSD17B10KDM4ECYP1A2
SCHEMBL19956902 0.69 KDM4E (0.38) GAAKDM4ECYP1A2CYP2D6
SCHEMBL17532555 0.69 POLB (0.31) —

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.

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