SCHEMBL544671

SCHEMBL544671

NC(=O)C(N)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.50
CYP2D6 P10635 2/20 0.48
SRC P12931 1/20 0.48
DPP4 P27487 2/20 0.48
F2 P00734 1/20 0.48
LMNA P02545 2/20 0.46
MAPK1 P28482 1/20 0.46
CYP1A2 P05177 1/20 0.45
PKM P14618 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
ALOX5 P09917 1/20 0.45
CTSD P07339 1/20 0.45
CES2 O00748 1/20 0.44
CES1 P23141 1/20 0.44

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
SCHEMBL1218849 1.00 EPHX1 (0.50) EPHX1CYP2D6SRCDPP4F2
SCHEMBL2332933 1.00 EPHX1 (0.50) EPHX1CYP2D6SRCDPP4F2
Hydrochloric Acid SCHEMBL1137431 0.98 EPHX1 (0.48) EPHX1CYP2D6SRCDPP4F2
Hydrochloric Acid SCHEMBL28645850 0.98 EPHX1 (0.48) EPHX1CYP2D6SRCDPP4F2
Hydrochloric Acid SCHEMBL1137429 0.98 EPHX1 (0.48) EPHX1CYP2D6SRCDPP4F2
Methane SCHEMBL6241814 0.98 EPHX1 (0.48) EPHX1CYP2D6SRCDPP4F2
Hydrochloric Acid SCHEMBL1137441 0.98 EPHX1 (0.48) EPHX1CYP2D6SRCDPP4F2
Hydrochloric Acid SCHEMBL27583753 0.95 EPHX1 (0.47) EPHX1CYP2D6SRCDPP4F2
Acetic Acid SCHEMBL27430362 0.93 ALOX5 (0.46) EPHX1CYP2D6SRCDPP4F2
SCHEMBL7193261 0.87 PTGS2 (0.52) DPP4SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117285504-A Amino phenylacetamide derivative and preparation method and application thereof 桂林医学院 2023-12-26 CN claimed
CN-107698484-A A kind of preparation method of derivative of lenalidomide and application 广东中科药物研究有限公司 2018-02-16 CN claimed
EP-2462141-B1 NOVEL AZAHETEROCYCLIC COMPOUNDS MERCK PATENT GMBH (DE) 2017-09-27 EP claimed
CN-105732413-A Synthetic process of chiral N-aromatic amino acid amide 成都理工大学 2016-07-06 CN claimed
US-9023847-B2 Azaheterocyclic compounds MERCK PATENT GMBH (DE) 2015-05-05 US claimed
EP-2546234-A1 Nitrogeneous heterocyclic derivative and medicine containing the same as an active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2013-01-16 EP claimed
US-20120277228-A1 Novel Azaheterocyclic Compounds MERCK PATENT GMBH (DE) 2012-11-01 US claimed
EP-2462141-A1 NOVEL AZAHETEROCYCLIC COMPOUNDS Merck Patent GmbH (DE) 2012-06-13 EP claimed
CN-101511352-A Lactam containing HCV inhibitors NOVARTIS AG (CH) 2009-08-19 CN claimed
US-20090042858-A1 LACTAM CONTAINING HCV INHIBITORS BARSANTI PAUL 2009-02-12 US claimed
EP-0034443-B1 BETA-LACTAM ANTIBACTERIAL COMPOUNDS, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM BEECHAM GROUP PLC (GB) 1984-09-26 EP claimed
US-4407815-A AMINO ACID DERIVATIVE ANTIBIOTICS BEECHAM GROUP LIMITED (GB) 1983-10-04 US claimed
EP-0061313-A2 Bis-esters of 1,1-alkanediols with 6-beta-hydroxymethylpenicillanic acid 1,1-dioxide and beta-lactam antibiotics PFIZER INC. (US) 1982-09-29 EP claimed
US-4342869-A Cephalosporin antibiotics MERCK & CO., INC. (US) 1982-08-03 US claimed
US-4338437-A Cephalosporin antibiotics MERCK & CO., INC. (US) 1982-07-06 US claimed
US-4338438-A Cephalosporin antibiotics MERCK & CO., INC. (US) 1982-07-06 US claimed
US-4297488-A 7-α-Methoxy cephalosporins MERCK & CO., INC. (US) 1981-10-27 US claimed
EP-0005507-A1 Process for the fragmentation of 3-(2-hydroxyimino-acetylamino)-2-oxo azetidin compounds and compounds obtained thereby CIBA-GEIGY AG (CH) 1979-11-28 EP claimed
US-4072674-A FOR CEPHALOSPORIN CONGENERS SMITHKLINE CORPORATION (US) 1978-02-07 US claimed
US-4062842-A Method for preparing 7-substituted cephalosporins and 6-substituted penicillins by replacement of sulfur-containing groups E. R. SQUIBB & SONS, INC. (US) 1977-12-13 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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-20120277228-A1 Novel Azaheterocyclic Compounds PCNA, MCL1, MYC EPHX1 2026/4885CYP2D6 2277/4885SRC 1347/4885
US-20090042858-A1 LACTAM CONTAINING HCV INHIBITORS SARS1, ZC3HAV1, ACE2 EPHX1 2765/4885CYP2D6 1258/4885SRC 3141/4885

“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.