SCHEMBL2885109

SCHEMBL2885109

COC(=O)c1c(C(=O)c2cc3ccccc3o2)n(S(=O)(=O)c2ccccc2)c2cccc(OCc3ccccc3)c12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 1/20 0.41
BCAT1 P54687 1/20 0.39
ABCG2 Q9UNQ0 3/20 0.39
ABCB1 P08183 2/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
KDM4E B2RXH2 1/20 0.39
AGTR1 P30556 1/20 0.39
GAA P10253 4/20 0.38
NPC1 O15118 3/20 0.38
RAB9A P51151 3/20 0.38
LMNA P02545 4/20 0.38
ALDH1A1 P00352 2/20 0.38
MAPT P10636 1/20 0.38
BCL2 P10415 1/20 0.38
BID P55957 1/20 0.38
MCL1 Q07820 1/20 0.38
MMP2 P08253 1/20 0.37
MTNR1B P49286 1/20 0.37
MAPK1 P28482 1/20 0.37

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
SCHEMBL12344897 0.85 EDNRA (0.40) EDNRABCAT1ABCG2ABCB1MEN1
SCHEMBL2887464 0.85 EDNRA (0.39) EDNRABCAT1ABCG2ABCB1MEN1
SCHEMBL2886004 0.85 CASP3 (0.43) BCAT1KMT2AGAALMNAALDH1A1
SCHEMBL2888688 0.84 GAA (0.41) BCAT1KMT2AGAALMNAALDH1A1
SCHEMBL2887531 0.83 MEN1 (0.43) BCAT1MEN1KMT2AKDM4EAGTR1
SCHEMBL12344893 0.81 EDNRA (0.38) EDNRABCAT1ABCG2ABCB1MEN1
SCHEMBL2879777 0.79 MAPT (0.46) BCAT1KDM4EGAANPC1RAB9A
SCHEMBL2879837 0.78 HPGD (0.39) BCAT1MEN1KMT2AKDM4EAGTR1
SCHEMBL12344892 0.76 GAA (0.42) BCAT1KMT2AGAALMNAALDH1A1
SCHEMBL2887785 0.72 MAOA (0.41) GAALMNAALDH1A1BCL2BID

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
EP-2035429-B1 FUSED [d]PYRIDAZIN-7-ONES CEPHALON INC (US) 2012-09-19 EP disclosed
US-7732447-B2 such as 4-Pyridin-3-yl-2,5-dihydro-pyridazino[4,5-b]indol-1-one, used as inhibitors of vascular endothelial growth factor receptor (VEGFR) kinase, mixed lineage kinase (MLK) or cyclin-dependent kinase (CDK); treatment of angiogenic disorders and neurodegenerative diseases CEPHALON, INC. (US) 2010-06-08 US disclosed
US-7732447-B2 such as 4-Pyridin-3-yl-2,5-dihydro-pyridazino[4,5-b]indol-1-one, used as inhibitors of vascular endothelial growth factor receptor (VEGFR) kinase, mixed lineage kinase (MLK) or cyclin-dependent kinase (CDK); treatment of angiogenic disorders and neurodegenerative diseases CEPHALON, INC. (US) 2010-06-08 US disclosed
US-7732447-B2 such as 4-Pyridin-3-yl-2,5-dihydro-pyridazino[4,5-b]indol-1-one, used as inhibitors of vascular endothelial growth factor receptor (VEGFR) kinase, mixed lineage kinase (MLK) or cyclin-dependent kinase (CDK); treatment of angiogenic disorders and neurodegenerative diseases CEPHALON, INC. (US) 2010-06-08 US disclosed
US-20070299061-A1 Fused [d]pyridazin-7-ones CEPHALON, INC. (US) 2007-12-27 US disclosed
US-20070299061-A1 Fused [d]pyridazin-7-ones CEPHALON, INC. (US) 2007-12-27 US disclosed
US-20070299061-A1 Fused [d]pyridazin-7-ones CEPHALON, INC. (US) 2007-12-27 US disclosed
WO-2007149557-A1 FUSED [d]PYRIDAZIN-7-ONES CEPHALON, INC. (US) 2007-12-27 WO 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 (1 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-20070299061-A1 Fused [d]pyridazin-7-ones CDK5, CDK5R1, CDK7 EDNRA 2154/4885BCAT1 3577/4885ABCG2 3180/4885

“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.