SCHEMBL2979894

SCHEMBL2979894

O=C(O)c1c[nH]c2ccc(Br)cc2c1=O

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.68
GABRA1 P14867 1/20 0.64
GABRB1 P18505 1/20 0.64
GABRA3 P34903 1/20 0.64
GABRB2 P47870 1/20 0.64
NR4A2 P43354 1/20 0.57
HTT P42858 1/20 0.56
HSD17B10 Q99714 4/20 0.55
CYP1A2 P05177 2/20 0.55
F7 P08709 1/20 0.53
F3 P13726 1/20 0.53
HPGD P15428 3/20 0.51
MEN1 O00255 1/20 0.51
ALDH1A1 P00352 1/20 0.51
ALOX12 P18054 1/20 0.51
KMT2A Q03164 1/20 0.51
GAA P10253 1/20 0.51
MAPT P10636 1/20 0.51
CYP2C19 P33261 1/20 0.51
POLB P06746 1/20 0.49

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
SCHEMBL2085712 0.90 NR4A2 (0.69) KDM4EGABRA1GABRB1GABRA3GABRB2
SCHEMBL27795085 0.87 GABRA1 (0.64) KDM4EGABRA1GABRB1GABRA3GABRB2
SCHEMBL4342972 0.87 CYP1A2 (0.62) KDM4EGABRA1GABRB1GABRA3GABRB2
SCHEMBL28289122 0.84 ALDH1A1 (0.60) KDM4EGABRA1GABRB1GABRA3GABRB2
SCHEMBL25189120 0.82 KDM4E (0.69) KDM4EHTTHSD17B10CYP1A2F7
SCHEMBL18589545 0.82 KDM4E (0.69) KDM4EHTTHSD17B10CYP1A2F7
SCHEMBL28289148 0.82 GABRA1 (0.62) KDM4EGABRA1GABRB1GABRA3GABRB2
SCHEMBL28289141 0.81 GABRA1 (0.57) KDM4EGABRA1GABRB1GABRA3GABRB2
SCHEMBL11143666 0.81 KDM4E (0.68) KDM4EHTTHSD17B10CYP1A2F7
SCHEMBL2479663 0.81 KDM4E (0.68) KDM4EGABRA1GABRB2HTTHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009040377-A2 IMAGING AGENTS GE HEALTHCARE LIMITED (GB) 2009-04-02 WO claimed
US-20230348462-A1 IMIDAZO[4,5-C]QUINOLINE COMPOUNDS AND THEIR USE AS ATM KINASE INHIBITORS DEUTSCHES KREBSFORSCHUNGSZENTRUM (DE) 2023-11-02 US disclosed
US-20230348462-A1 IMIDAZO[4,5-C]QUINOLINE COMPOUNDS AND THEIR USE AS ATM KINASE INHIBITORS DEUTSCHES KREBSFORSCHUNGSZENTRUM (DE) 2023-11-02 US disclosed
CN-113185505-B Quinolone oxazolidinone compound and preparation method and application thereof 中国农业大学 2022-09-27 CN disclosed
WO-2022096361-A1 IMIDAZO[4,5-C]QUINOLINE COMPOUNDS AND THEIR USE AS ATM KINASE INHIBITORS DEUTSCHES KREBSFORSCHUNGSZENTRUM (DE) 2022-05-12 WO disclosed
EP-3992191-A1 IMIDAZO[4,5-C]QUINOLINE COMPOUNDS AND THEIR USE AS ATM KINASE INHIBITORS Deutsches Krebsforschungszentrum (DE) 2022-05-04 EP disclosed
CN-113185505-A Quinolone oxazolidinone compound and preparation method and application thereof 中国农业大学 2021-07-30 CN disclosed
CN-109942654-B Macrolide and quinolone heterocomplex and preparation method thereof 北京理工大学 2021-06-11 CN disclosed
US-20190185468-A1 Imidazo[4,5-c]quinolin-2-one Compounds and Their Use in Treating Cancer ASTRAZENECA UK LIMITED (GB) 2019-06-20 US disclosed
US-20190185468-A1 Imidazo[4,5-c]quinolin-2-one Compounds and Their Use in Treating Cancer ASTRAZENECA UK LIMITED (GB) 2019-06-20 US disclosed
US-20140343098-A1 MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS VERTEX PHARMACEUTICALS INCORPORATED (US) 2014-11-20 US disclosed
US-8802700-B2 Modulators of ATP-Binding Cassette transporters VERTEX PHARMACEUTICALS INCORPORATED (US) 2014-08-12 US disclosed
US-8614327-B2 Modulators of ATP-binding cassette transporters VERTEX PHARMACEUTICALS INCORPORATED (US) 2013-12-24 US disclosed
CN-103224466-A Compound with beta-secretase inhibition function, its preparation method and application UNIV BEIJING 2013-07-31 CN disclosed
US-20130165442-A1 Modulators of ATP-Binding Cassette Transporters VERTEX PHARMACEUTICALS INCORPORATED (US) 2013-06-27 US disclosed
US-8354427-B2 Modulators of ATP-binding cassette transporters VERTEX PHARMACEUTICAL INCORPORATED (US) 2013-01-15 US disclosed
US-20120309758-A1 MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-12-06 US disclosed
US-20100184739-A1 Modulators of ATP-Binding Cassette Transporters VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-07-22 US disclosed
CN-101624371-A 4-carbostyril and 4H-1,4-benzothiazine derivatives and preparation method and application thereof UNIV CHINA PHARMA 2010-01-13 CN disclosed
WO-2009040377-A2 IMAGING AGENTS GE HEALTHCARE LIMITED (GB) 2009-04-02 WO 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 (6 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-20130165442-A1 Modulators of ATP-Binding Cassette Transporters CFTR, ABCB1, ABCC2 KDM4E 4262/4885GABRA1 1047/4885GABRB1 306/4885
US-20100184739-A1 Modulators of ATP-Binding Cassette Transporters CFTR, ABCB1, ABCC2 KDM4E 4262/4885GABRA1 1047/4885GABRB1 306/4885
US-20230348462-A1 IMIDAZO[4,5-C]QUINOLINE COMPOUNDS AND THEIR USE AS ATM KINASE INHIBITORS ATM, CHEK2, CHEK1 KDM4E 1625/4885GABRA1 3335/4885GABRB1 3235/4885
US-20140343098-A1 MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS CFTR, ABCB1, ABCC2 KDM4E 4262/4885GABRA1 1047/4885GABRB1 306/4885
US-20190185468-A1 Imidazo[4,5-c]quinolin-2-one Compounds and Their Use in Treating Cancer ATM, CHEK2, CHEK1 KDM4E 2059/4885GABRA1 3722/4885GABRB1 4247/4885
US-20120309758-A1 MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS CFTR, ABCB1, ABCC2 KDM4E 4262/4885GABRA1 1047/4885GABRB1 306/4885

“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.