SCHEMBL1504031

SCHEMBL1504031

O=C(O)c1cc(=O)c2cc(Cl)ccc2[nH]1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.77
KMT2A Q03164 5/20 0.77
HPGD P15428 4/20 0.77
KDM4E B2RXH2 2/20 0.77
MAPK1 P28482 2/20 0.77
CYP2C9 P11712 2/20 0.77
BLM P54132 2/20 0.77
LMNA P02545 1/20 0.77
NGFR P08138 1/20 0.67
CYP1A2 P05177 3/20 0.63
GRIN2D O15399 3/20 0.63
GRIN3B O60391 3/20 0.63
GRIN1 Q05586 3/20 0.63
GRIN2A Q12879 3/20 0.63
GRIN2B Q13224 3/20 0.63
GRIN2C Q14957 3/20 0.63
GRIN3A Q8TCU5 3/20 0.63
GAA P10253 2/20 0.63
ALDH1A1 P00352 2/20 0.63
GPR35 Q9HC97 2/20 0.63

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
7-Chlorokynurenic Acid SCHEMBL2680493 0.87 HPGD (1.00) MEN1KMT2AHPGDKDM4EMAPK1
SCHEMBL11698420 0.83 NGFR (0.71) MEN1KMT2AHPGDKDM4EMAPK1
SCHEMBL9441968 0.82 GRIN1 (0.77) MEN1KMT2AHPGDKDM4EMAPK1
SCHEMBL1503904 0.81 HPGD (0.56) MEN1KMT2AHPGDKDM4EMAPK1
SCHEMBL4516264 0.81 NGFR (0.69) MEN1KMT2AHPGDKDM4EMAPK1
SCHEMBL9452339 0.80 NGFR (0.67) MEN1KMT2AHPGDKDM4EMAPK1
SCHEMBL8210976 0.80 NGFR (0.67) MEN1KMT2AHPGDKDM4EMAPK1
SCHEMBL11615435 0.80 NGFR (0.67) MEN1KMT2AHPGDKDM4EMAPK1
SCHEMBL9452255 0.80 NGFR (0.67) MEN1KMT2AHPGDKDM4EMAPK1
SCHEMBL9452271 0.80 NGFR (0.67) MEN1KMT2AHPGDKDM4EMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1405852-B9 DIAMINE DERIVATIVES DAIICHI SANKYO CO LTD (JP) 2013-03-27 EP disclosed
CN-1826333-B Diamine derivatives DAIICHI SANKYO CO LTD 2012-12-26 CN disclosed
EP-1577301-B1 Antithrombotic diaminocyclohexane derivatives DAIICHI SANKYO CO LTD (JP) 2012-09-12 EP disclosed
EP-1577301-B1 Antithrombotic diaminocyclohexane derivatives DAIICHI SANKYO CO LTD (JP) 2012-09-12 EP disclosed
EP-1405852-B1 DIAMINE DERIVATIVES DAIICHI SANKYO CO LTD (JP) 2012-08-01 EP disclosed
US-20110312990-A1 Diamine Derivatives DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-12-22 US disclosed
US-20110312990-A1 Diamine Derivatives DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-12-22 US disclosed
US-20110312990-A1 Diamine Derivatives DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-12-22 US disclosed
EP-2343290-A1 Diamine derivatives as factor X inhibitors Daiichi Sankyo Company, Limited (JP) 2011-07-13 EP disclosed
US-20110077266-A1 Diamine Derivatives DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-03-31 US disclosed
CN-1751025-A Diamine derivatives DAIICHI SEIYAKU CO (JP) 2006-03-22 CN disclosed
US-20050245565-A1 Diamine derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2005-11-03 US disclosed
EP-1577301-A1 DIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2005-09-21 EP disclosed
US-20050119486-A1 Diamine derivatives DAIICHI SANKYO COMPANY, LIMITED (JP) 2005-06-02 US disclosed
US-20050020645-A1 Diamine derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2005-01-27 US disclosed
EP-1415992-A1 DIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2004-05-06 EP disclosed
EP-1405852-A1 DIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2004-04-07 EP disclosed
US-5270309-A Kynurenic acid derivatives useful in the treatment of neurodegenerative disorders MERCK SHARP & DOHME LIMITED (GB) 1993-12-14 US disclosed
EP-0303387-B1 KYNURENIC ACID DERIVATIVES USEFUL IN THE TREATMENT OF NEURODEGENERATIVE DISORDERS MERCK SHARP & DOHME LTD. (GB) 1993-04-21 EP disclosed
EP-0303387-A1 Kynurenic acid derivatives useful in the treatment of neurodegenerative disorders MERCK SHARP & DOHME LTD. (GB) 1989-02-15 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 (5 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-20050020645-A1 Diamine derivatives C9, C1S, C1R MEN1 457/4885KMT2A 3485/4885HPGD 2022/4885
US-20050245565-A1 Diamine derivatives C9, C1S, C1R MEN1 457/4885KMT2A 3485/4885HPGD 2022/4885
US-20050119486-A1 Diamine derivatives C9, C1S, C1R MEN1 457/4885KMT2A 3485/4885HPGD 2022/4885
US-20110077266-A1 Diamine Derivatives F2, TFPI, F3 MEN1 1094/4885KMT2A 1453/4885HPGD 539/4885
US-20110312990-A1 Diamine Derivatives C9, C1S, C1R MEN1 602/4885KMT2A 3461/4885HPGD 1811/4885

“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.