SCHEMBL3160169

SCHEMBL3160169

CCOC(=O)c1cnc(SC)[nH]c1=O

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM6B O15054 2/20 0.63
▸ KDM4A O75164 2/20 0.63
▸ KDM4D Q6B0I6 2/20 0.63
▸ HIF1AN Q9NWT6 2/20 0.63
▸ KDM2A Q9Y2K7 2/20 0.63
▸ CA12 O43570 4/20 0.56
▸ CA1 P00915 4/20 0.56
▸ CA2 P00918 4/20 0.56
▸ CA6 P23280 4/20 0.56
▸ CA7 P43166 4/20 0.56
▸ CA13 Q8N1Q1 4/20 0.56
▸ KDM4E B2RXH2 6/20 0.53
▸ ALDH1A1 P00352 5/20 0.53
▸ MAPT P10636 3/20 0.53
▸ L3MBTL1 Q9Y468 3/20 0.53
▸ GAA P10253 3/20 0.53
▸ POLB P06746 2/20 0.53
▸ TDP1 Q9NUW8 1/20 0.53
▸ KDM3B Q7LBC6 1/20 0.53
▸ KDM5B Q9UGL1 1/20 0.53

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
SCHEMBL15349519 0.97 KDM6B (0.60) KDM6BKDM4AKDM4DHIF1ANKDM2A
SCHEMBL10766398 0.87 KDM4E (0.55) KDM6BKDM4AKDM4DHIF1ANKDM2A
SCHEMBL11013238 0.83 CA12 (0.57) KDM6BKDM4AKDM4DHIF1ANKDM2A
SCHEMBL10783573 0.83 KDM6B (0.57) KDM6BKDM4AKDM4DHIF1ANKDM2A
SCHEMBL1014580 0.81 KDM4E (0.58) CA12CA1CA2CA6CA7
SCHEMBL12408070 0.80 KDM6B (0.44) KDM6BKDM4AKDM4DHIF1ANKDM2A
SCHEMBL2217764 0.79 KDM4E (0.53) CA12CA1CA2CA6CA7
SCHEMBL7997265 0.79 KDM4E (0.55) CA12CA1CA2CA6CA7
SCHEMBL2902593 0.79 ALDH1A1 (0.66) CA12CA1CA2CA6CA7
SCHEMBL18585976 0.79 ALDH1A1 (0.59) CA12CA1CA2CA6CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0225175-A2 Dihydropyridine derivatives, processes for their preparation and pharmaceutical compositions thereof FISONS plc (GB) 1987-06-10 — — EP claimed
JP-60100559-A — — None — — JP disclosed
US-10364247-B2 Preparation and use of novel protein kinase inhibitors RUIJIN HOSPITAL AFFILIATED TO SHANGHAI JIAO TONG UNIVERSITY SCHOOL OF MEDICINE (CN) 2019-07-30 — — US disclosed
EP-2841070-B1 DESIGN AND SYNTHESIS OF NOVEL INHIBITORS OF ISOPRENOID BIOSYNTHESIS UNIV NORTHERN ILLINOIS BOARD OF TRUSTEES (US) 2018-07-25 — — EP disclosed
US-20180105528-A1 PREPARATION AND USE OF NOVEL PROTEIN KINASE INHIBITORS BRANDEIS UNIVERSITY 2018-04-19 — — US disclosed
US-20180105528-A1 PREPARATION AND USE OF NOVEL PROTEIN KINASE INHIBITORS BRANDEIS UNIVERSITY 2018-04-19 — — US disclosed
US-9890126-B2 Synthesis of novel inhibitors of isoprenoid biosynthesis (ISPF) BOARD OF TRUSTEES OF NORTHERN ILLINOIS UNIVERSITY (US) 2018-02-13 — — US disclosed
US-9890126-B2 Synthesis of novel inhibitors of isoprenoid biosynthesis (ISPF) BOARD OF TRUSTEES OF NORTHERN ILLINOIS UNIVERSITY (US) 2018-02-13 — — US disclosed
US-9890126-B2 Synthesis of novel inhibitors of isoprenoid biosynthesis (ISPF) BOARD OF TRUSTEES OF NORTHERN ILLINOIS UNIVERSITY (US) 2018-02-13 — — US disclosed
WO-2016168992-A1 PREPARATION AND USE OF NOVEL PROTEIN KINASE INHIBITORS RUIJIN HOSPITAL AFFILIATED TO SHANGHAI JIAO TONG UNIVERSITY SCHOOL OF MEDICINE (CN) 2016-10-27 — — WO disclosed
WO-2013163159-A2 DESIGN AND SYNTHESIS OF NOVEL INHIBITORS OF ISOPRENOID BIOSYNTHESIS BOARD OF TRUSTEES OF NORTHERN ILLINOIS UNIVERSITY (US) 2013-10-31 — — WO disclosed
US-20100010025-A1 Pyrimidine Derivatives NORVARTIS AG 2010-01-14 — — US disclosed
EP-1309565-B1 HETEROCYCLIC MUTILIN ESTERS AND THEIR USE AS ANTIBACTERIALS SMITHKLINE BEECHAM PLC (GB) 2008-04-09 — — EP disclosed
US-6878704-B2 Heterocyclic mutilin esters and their use as antibacterials SMITHKLINE BEECHAM P.L.C. (GB) 2005-04-12 — — US disclosed
US-20040058937-A1 Heterocyclic mutilin esters and their use as antibacterials SMITHKLINE BEECHAM P.L.C. (GB) 2004-03-25 — — US disclosed
EP-1309565-A1 HETEROCYCLIC MUTILIN ESTERS AND THEIR USE AS ANTIBACTERIALS SMITHKLINE BEECHAM PLC (GB) 2003-05-14 — — EP disclosed
WO-2002012199-A1 HETEROCYCLIC MUTILIN ESTERS AND THEIR USE AS ANTIBACTERIALS SMITHKLINE BEECHAM P.L.C. (GB) 2002-02-14 — — WO disclosed
EP-0144730-B1 2-ANILINO-1,6-DIHYDRO-6-OXO-5-PYRIMIDINECARBOXYLIC ACID DERIVATIVES, PROCESSES FOR THE PREPARATION THEREOF, AND ANTIALLERGIC AGENT CONTAINING THE SAME MORISHITA PHARMACEUTICAL CO. LTD. (JP) 1987-07-08 — — EP disclosed
EP-0144730-A1 2-Anilino-1,6-dihydro-6-oxo-5-pyrimidinecarboxylic acid derivatives, processes for the preparation thereof, and antiallergic agent containing the same MORISHITA PHARMACEUTICAL CO. LTD. (JP) 1985-06-19 — — EP disclosed
JP-S60100559-A 2-ANILINO-1,6-DIHYDRO-6-OXO-5-PYRIMIDINECARBOXYLIC ACID DERIVATIVE, ITS PREPARATION, AND ANTIALLERGIC CONTAINING IT MORISHITA SEIYAKU KK 1985-06-04 — — JP 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 (4 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-20040058937-A1 Heterocyclic mutilin esters and their use as antibacterials MLN, MSH2, MRPL21 KDM6B 4440/4885KDM4A 3952/4885KDM4D 4508/4885
US-20100010025-A1 Pyrimidine Derivatives DPYD, TYMP, TYMS KDM6B 2681/4885KDM4A 3425/4885KDM4D 2653/4885
US-10364247-B2 Preparation and use of novel protein kinase inhibitors MAP3K20, MAP3K19, MAP3K5 KDM6B 1732/4885KDM4A 2530/4885KDM4D 2649/4885
US-20180105528-A1 PREPARATION AND USE OF NOVEL PROTEIN KINASE INHIBITORS MAP3K20, MAP3K19, MAP3K5 KDM6B 1732/4885KDM4A 2530/4885KDM4D 2649/4885

“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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