SCHEMBL2887045

SCHEMBL2887045

O=Cc1cn(S(=O)(=O)c2ccccc2)c2cccc(OCc3ccccc3)c12

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.45
UBE2N P61088 1/20 0.45
HTR6 P50406 14/20 0.45
BCHE P06276 3/20 0.45
CCNB2 O95067 1/20 0.41
CDK1 P06493 1/20 0.41
CDK4 P11802 1/20 0.41
CCNB1 P14635 1/20 0.41
CCND1 P24385 1/20 0.41
CCNB3 Q8WWL7 1/20 0.41
LTB4R Q15722 2/20 0.40
LTB4R2 Q9NPC1 2/20 0.40

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
SCHEMBL12344913 0.89 CCNB2 (0.40) HTR6BCHECCNB2CDK1CDK4
SCHEMBL3046174 0.83 HTR6 (0.47) HTR6BCHE
SCHEMBL3048085 0.79 ALK (0.54) CCNB2CDK1CDK4CCNB1CCND1
SCHEMBL2887000 0.78 MEN1 (0.60) HTR6BCHELTB4RLTB4R2
SCHEMBL29111293 0.76 KDM4E (0.52) KDM4EUBE2NHTR6
SCHEMBL3045523 0.76 HTR6 (0.49) HTR6
SCHEMBL2879677 0.76 HTR6 (0.55) KDM4EUBE2NHTR6LTB4R
SCHEMBL2886894 0.76 HTR6 (0.63) KDM4EUBE2NHTR6LTB4R
SCHEMBL28864412 0.74 KDM4E (0.50) KDM4EUBE2NHTR6
SCHEMBL17927509 0.74 HTR6 (0.71) HTR6BCHE

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
EP-2035429-A1 FUSED [d]PYRIDAZIN-7-ONES Cephalon, Inc. (US) 2009-03-18 EP 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
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 KDM4E 1305/4885UBE2N 1390/4885HTR6 1506/4885

“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.