SCHEMBL2114977

SCHEMBL2114977

O=C(O)c1c[nH]c2ncccc2c1=O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 1/20 0.67
MAP2K1 Q02750 1/20 0.59
TET2 Q6N021 1/20 0.58
TET1 Q8NFU7 1/20 0.58
CAMKK2 Q96RR4 3/20 0.55
CSNK2A2 P19784 1/20 0.51
CSNK2B P67870 1/20 0.51
CSNK2A1 P68400 1/20 0.51
KMT2A Q03164 1/20 0.49
KDM4E B2RXH2 2/20 0.49
AXL P30530 1/20 0.49
CAMKK1 Q8N5S9 1/20 0.48
CNR2 P34972 1/20 0.48
ALDH1A1 P00352 1/20 0.48
HPGD P15428 1/20 0.48
GPR84 Q9NQS5 1/20 0.47
DNA2 P51530 1/20 0.47
CASP6 P55212 1/20 0.47
CTDSP1 Q9GZU7 1/20 0.47
MET P08581 1/20 0.47

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
Hydrochloric Acid SCHEMBL10655021 0.98 ADORA2A (0.65) ADORA2AMAP2K1TET2TET1CAMKK2
SCHEMBL985214 0.90 MAP2K1 (0.71) ADORA2AMAP2K1CAMKK2KMT2AKDM4E
SCHEMBL29468201 0.90 MAP2K1 (0.71) ADORA2AMAP2K1CAMKK2KMT2AKDM4E
Hydrochloric Acid SCHEMBL3608101 0.88 MAP2K1 (0.69) ADORA2AMAP2K1CAMKK2KMT2AKDM4E
SCHEMBL11883907 0.86 MAP2K1 (0.61) ADORA2AMAP2K1TET2TET1CAMKK2
SCHEMBL1820660 0.86 ADORA2A (0.61) ADORA2AMAP2K1TET2TET1CAMKK2
Methoxymethane SCHEMBL28146835 0.84 MAP2K1 (0.77) ADORA2AMAP2K1CAMKK2KMT2AAXL
SCHEMBL28164021 0.83 MAP2K1 (0.81) ADORA2AMAP2K1CAMKK2KMT2AKDM4E
SCHEMBL2638921 0.83 ADORA2A (0.70) ADORA2AMAP2K1CAMKK2KMT2AAXL
SCHEMBL18306013 0.80 ADORA2A (0.55) ADORA2AMAP2K1TET2TET1CAMKK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110475777-A For treating and preventing new pyrido [2,3-b] benzazolyl compounds of bacterium infection HOFFMANN LA ROCHE 2019-11-19 CN claimed
EP-1401829-B1 NOVEL HETEROCYCLIC ANTIBACTERIAL COMPOUNDS MICROBIOTIX INC (US) 2012-08-22 EP claimed
US-20120093917-A1 METNASE AND INTNASE INHIBITORS AND THEIR USE IN TREATING CANCER THE REGENTS OF THE UNIVERSITY OF NEW MEXICO 2012-04-19 US claimed
WO-2010114919-A2 METNASE AND INTNASE INHIBITORS AND THEIR USE IN TREATING CANCER STC.UNM (US) 2010-10-07 WO claimed
EP-1401829-A4 NOVEL HETEROCYCLIC ANTIBACTERIAL COMPOUNDS MICROBIOTIX INC (US) 2004-10-27 EP claimed
EP-1401829-A1 NOVEL HETEROCYCLIC ANTIBACTERIAL COMPOUNDS Microbiotix, Inc. (US) 2004-03-31 EP claimed
US-20030181719-A1 Novel heterocyclic antibacterial compounds MICROBIOTIX, INC. 2003-09-25 US claimed
EP-1305048-A2 INHIBITORS OF CELLULAR EFFLUX PUMPS OF MICROBES Wockhardt Limited (IN) 2003-05-02 EP claimed
WO-2002102792-A1 NOVEL HETEROCYCLIC ANTIBACTERIAL COMPOUNDS MICROBIOTIX, INC. (US) 2002-12-27 WO claimed
WO-2002009758-A2 INHIBITORS OF CELLULAR EFFLUX PUMPS OF MICROBES WOCKHARDT LIMITED (IN) 2002-02-07 WO claimed
US-5770597-A ANTIBIOTIC KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1998-06-23 US claimed
US-20240254136-A1 COMPOUNDS TARGETING RNA-BINDING PROTEINS OR RNA-MODIFYING PROTEINS Redona Therapeutics, Inc. 2024-08-01 US disclosed
CN-110520422-B Novel pyridonecarboxylic acid derivative or salt thereof 涌永制药株式会社 2023-09-05 CN disclosed
CN-109689656-B 7-substituted 1-arylnaphthyridine-3-carboxamides and their use 拜耳股份公司 2022-10-04 CN disclosed
CN-113773240-B Preparation method of gemifloxacin side chain compound 北京阳光诺和药物研究股份有限公司 2022-05-31 CN disclosed
EP-0266576-A2 1-Tert-alkyl-substituted naphthyridine and quinoline carboxylic acids as antibacterial agents Bristol-Myers Squibb Company (US) 1988-05-11 EP disclosed
WO-1988002627-A1 1-TERTIARY-ALKYL-SUBSTITUTED NAPHTHYRIDINE- AND QUINOLINE-CARBOXYLIC ACID ANTIBACTERIAL AGENTS BRISTOL-MYERS COMPANY (US) 1988-04-21 WO disclosed
US-4517191-A 1-Amino-1,8-naphthyridine compounds useful as bactericides STERLING DRUG INC. (US) 1985-05-14 US disclosed
US-4464363-A HYDROXY ARYL- OR HYDROXY ARALKYL ACIDS OR SALTS MERCK & CO., INC. (US) 1984-08-07 US disclosed
US-4195087-A BACTERICIDES, FEED ADDITIVES ABIC, LTD. (IL) 1980-03-25 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 (3 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-20120093917-A1 METNASE AND INTNASE INHIBITORS AND THEIR USE IN TREATING CANCER RNASE1, DCLRE1B, FEN1 ADORA2A 3791/4885MAP2K1 4024/4885TET2 479/4885
US-20030181719-A1 Novel heterocyclic antibacterial compounds TOP1, TOP2A, TOP2B ADORA2A 4346/4885MAP2K1 2997/4885TET2 2181/4885
US-20240254136-A1 COMPOUNDS TARGETING RNA-BINDING PROTEINS OR RNA-MODIFYING PROTEINS NSUN3, NSUN2, RBM3 ADORA2A 2360/4885MAP2K1 4666/4885TET2 1078/4885

“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.