SCHEMBL1786166

SCHEMBL1786166

COc1ccc(-c2oc3ncnc(Cl)c3c2-c2ccc(OC)cc2)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TEK Q02763 8/20 0.71
KDR P35968 5/20 0.71
KDM4E B2RXH2 4/20 0.65
ALDH1A1 P00352 4/20 0.65
HPGD P15428 4/20 0.65
UBE2N P61088 2/20 0.65
SMN1; SMN2 Q16637 1/20 0.65
CHEK1 O14757 1/20 0.60
CDK1 P06493 1/20 0.60
MEN1 O00255 4/20 0.58
KMT2A Q03164 4/20 0.58
GSK3B P49841 1/20 0.56
POLB P06746 2/20 0.56
RAD52 P43351 2/20 0.56
TP53 P04637 2/20 0.53
NPSR1 Q6W5P4 3/20 0.52
HSD17B10 Q99714 3/20 0.52
TSHR P16473 2/20 0.52
MAPT P10636 2/20 0.52
LMNA P02545 1/20 0.52

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
SCHEMBL1785974 0.95 KDM4E (0.74) TEKKDRKDM4EALDH1A1HPGD
SCHEMBL2975999 0.95 KDM4E (0.74) TEKKDRKDM4EALDH1A1HPGD
SCHEMBL6412162 0.86 TEK (0.56) TEKKDRKDM4EALDH1A1HPGD
SCHEMBL1787606 0.84 SMN1; SMN2 (0.55) TEKKDRKDM4EALDH1A1HPGD
SCHEMBL6201687 0.83 ALDH1A1 (0.59) TEKKDRKDM4EALDH1A1HPGD
SCHEMBL735560 0.81 TNK2 (0.68) KDM4EALDH1A1HPGDUBE2NSMN1; SMN2
SCHEMBL13271833 0.80 KDM4E (0.76) TEKKDRKDM4EALDH1A1HPGD
SCHEMBL14013982 0.80 TEK (0.92) TEKKDRKDM4EALDH1A1HPGD
SCHEMBL22320657 0.80 TEK (0.47) TEKKDRKDM4EALDH1A1HPGD
SCHEMBL14020859 0.79 KDM4E (0.74) TEKKDRKDM4EALDH1A1HPGD

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8324222-B2 Cyclically substituted furopyrimidine derivatives and use thereof BAYER INTELLECTUAL PROPERTY GMBH (DE) 2012-12-04 US disclosed
US-20110124665-A1 Novel, Cyclically Substituted Furopyrimidine Derivatives and Use Thereof BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2011-05-26 US disclosed
EP-1966218-B1 NOVEL, CYCLIC SUBSTITUTED FUROPYRIMIDINE DERIVATIVES AND USE THEREOF FOR TREATING CARDIOVASCULAR DISEASES BAYER SCHERING PHARMA AG (DE) 2010-07-14 EP disclosed
WO-2008131859-A2 USE OF CYCLICALLY SUBSTITUTED FUROPYRIMIDINE DERIVATIVES FOR TREATING PULMONARY ARTERIAL HYPERTONIA BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-11-06 WO disclosed
EP-1966218-A1 NOVEL, CYCLIC SUBSTITUTED FUROPYRIMIDINE DERIVATIVES AND USE THEREOF FOR TREATING CARDIOVASCULAR DISEASES Bayer HealthCare AG (DE) 2008-09-10 EP disclosed
WO-2007079861-A1 NOVEL, CYCLIC SUBSTITUTED FUROPYRIMIDINE DERIVATIVES AND USE THEREOF FOR TREATING CARDIOVASCULAR DISEASES BAYER HEALTHCARE AG (DE) 2007-07-19 WO disclosed
EP-1425283-B1 NOVEL 4-AMINOFUROPYRIMIDINES AND THE USE THEREOF BAYER HEALTHCARE AG (DE) 2005-03-16 EP disclosed
US-20040259888-A1 Novel 4-aminofuropyrimidines and the use thereof BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2004-12-23 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 (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-20110124665-A1 Novel, Cyclically Substituted Furopyrimidine Derivatives and Use Thereof DPYD, TK2, TPMT TEK 199/4885KDR 511/4885KDM4E 4173/4885
US-20040259888-A1 Novel 4-aminofuropyrimidines and the use thereof DPYD, TPMT, TYMP TEK 950/4885KDR 3628/4885KDM4E 1612/4885

“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.