SCHEMBL2923978

SCHEMBL2923978

COc1cc(-c2nc3sc4c(c3c(=O)n2CC(C)C)CCCC4=O)cc(OC)c1OC

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CDKN1A P38936 3/20 0.44
BRD4 O60885 1/20 0.42
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 2/20 0.40
NPC1 O15118 1/20 0.40
GAA P10253 1/20 0.40
POLB P06746 2/20 0.39
RXFP1 Q9HBX9 1/20 0.37
PTGS2 P35354 2/20 0.36
LMNA P02545 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
PDE4B Q07343 1/20 0.36
USP2 O75604 2/20 0.35
MAPT P10636 2/20 0.35
MIF P14174 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
HPGD P15428 1/20 0.34
HSD17B10 Q99714 1/20 0.34
DHFR P00374 1/20 0.34

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
SCHEMBL2922595 0.93 CDKN1A (0.42) CDKN1ABRD4KDM4EALDH1A1NPC1
SCHEMBL2921214 0.88 RXFP1 (0.50) CDKN1ABRD4KDM4EALDH1A1NPC1
SCHEMBL2924151 0.87 CDKN1A (0.43) CDKN1ABRD4KDM4EALDH1A1NPC1
SCHEMBL2920423 0.87 CDKN1A (0.57) CDKN1AKDM4EALDH1A1NPC1POLB
SCHEMBL2923793 0.85 HSD11B1 (0.48) CDKN1AKDM4EALDH1A1POLBRXFP1
SCHEMBL2923867 0.85 ALDH1A1 (0.42) CDKN1ABRD4KDM4EALDH1A1NPC1
SCHEMBL2917261 0.84 MAPT (0.43) CDKN1AKDM4EALDH1A1POLBRXFP1
SCHEMBL2918043 0.83 MAPT (0.56) CDKN1AKDM4EALDH1A1NPC1POLB
SCHEMBL2920439 0.82 RXFP1 (0.35) CDKN1AKDM4EALDH1A1POLBRXFP1
SCHEMBL2923006 0.80 DHFR (0.44) CDKN1ABRD4KDM4EALDH1A1NPC1

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.