SCHEMBL2922595

SCHEMBL2922595

CCC(C)Cn1c(-c2cc(OC)c(OC)c(OC)c2)nc2sc3c(c2c1=O)CCCC3=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDKN1A P38936 3/20 0.42
BRD4 O60885 1/20 0.40
KDM4E B2RXH2 3/20 0.38
ALDH1A1 P00352 2/20 0.38
GAA P10253 2/20 0.38
NPC1 O15118 1/20 0.38
POLB P06746 4/20 0.37
RXFP1 Q9HBX9 1/20 0.35
LMNA P02545 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
PTGS2 P35354 2/20 0.35
MAPT P10636 4/20 0.33
RECQL P46063 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
HSD17B10 Q99714 2/20 0.33
USP2 O75604 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
NR4A1 P22736 1/20 0.33
PTPN7 P35236 1/20 0.33

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
SCHEMBL2923978 0.93 CDKN1A (0.44) CDKN1ABRD4KDM4EALDH1A1GAA
SCHEMBL2925167 0.88 CDKN1A (0.54) CDKN1AKDM4EALDH1A1NPC1POLB
SCHEMBL2924151 0.86 CDKN1A (0.43) CDKN1ABRD4KDM4EALDH1A1GAA
SCHEMBL2922001 0.85 MAPT (0.41) CDKN1AKDM4EALDH1A1GAAPOLB
SCHEMBL2921214 0.85 RXFP1 (0.50) CDKN1ABRD4KDM4EALDH1A1GAA
SCHEMBL2923793 0.82 HSD11B1 (0.48) CDKN1AKDM4EALDH1A1POLBRXFP1
SCHEMBL2923867 0.82 ALDH1A1 (0.42) CDKN1ABRD4KDM4EALDH1A1GAA
SCHEMBL2920423 0.80 CDKN1A (0.57) CDKN1AKDM4EALDH1A1NPC1POLB
SCHEMBL2918043 0.80 MAPT (0.56) CDKN1AKDM4EALDH1A1NPC1POLB
SCHEMBL2923006 0.78 DHFR (0.44) CDKN1ABRD4KDM4EALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1635839-B1 BENZO[4,5]THIENO[2,3-D]PYRIMIDIN-4-ONES AND THEIR USE IN THERAPY ABBOTT HEALTHCARE PRODUCTS BV (NL) 2010-09-01 EP disclosed
US-7524853-B2 Compounds and their use in therapy SOLVAY PHARMACEUTICALS B.V. (NL) 2009-04-28 US disclosed
US-7524853-B2 Compounds and their use in therapy SOLVAY PHARMACEUTICALS B.V. (NL) 2009-04-28 US disclosed
US-7524853-B2 Compounds and their use in therapy SOLVAY PHARMACEUTICALS B.V. (NL) 2009-04-28 US disclosed
US-7465739-B2 Compounds and their use in therapy SOLVAY PHARMACEUTICALS B.V. (NL) 2008-12-16 US disclosed
US-7465739-B2 Compounds and their use in therapy SOLVAY PHARMACEUTICALS B.V. (NL) 2008-12-16 US disclosed
US-7465739-B2 Compounds and their use in therapy SOLVAY PHARMACEUTICALS B.V. (NL) 2008-12-16 US disclosed
EP-1635839-A2 BENZO[4,5]THIENO[2,3-D]PYRIMIDIN-4-ONES AND THEIR USE IN THERAPY Solvay Pharmaceuticals B.V. (NL) 2006-03-22 EP disclosed
US-20050176742-A1 Novel compounds and their use in therapy SOLVAY PHARMACEUTICALS B.V. (NL) 2005-08-11 US disclosed
WO-2005032527-A2 BENZO (4, 5) THIENO (2, 3-D) PYRIMIDIN-4-ONES AND THEIR USE IN THERAPY SOLVAY PHARMACEUTICALS B.V. (NL) 2005-04-14 WO disclosed
US-20050038053-A1 Novel compounds and their use in therapy SOLVAY PHARMACEUTICALS B.V. (NL) 2005-02-17 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-20050176742-A1 Novel compounds and their use in therapy HSD17B11, HSD17B2, HSD17B1 CDKN1A 849/4885BRD4 1485/4885KDM4E 2665/4885
US-20050038053-A1 Novel compounds and their use in therapy HSD17B11, HSD17B2, HSD17B1 CDKN1A 849/4885BRD4 1485/4885KDM4E 2665/4885

“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.