SCHEMBL896296

SCHEMBL896296

Cc1n[nH]c(=O)c(-c2nccnc2Cl)c1-c1ccc(Cl)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD1 P21728 6/20 0.39
IKBKB O14920 1/20 0.39
MAP3K14 Q99558 1/20 0.39
NOTUM Q6P988 2/20 0.37
PDE3B Q13370 1/20 0.35
PDE3A Q14432 1/20 0.35
ALPL P05186 1/20 0.35
GYS1 P13807 1/20 0.35
MEN1 O00255 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
GAA P10253 1/20 0.35
CYP2D6 P10635 1/20 0.35
MAPT P10636 1/20 0.35
CYP2C9 P11712 1/20 0.35
ALOX15 P16050 1/20 0.35
ALOX12 P18054 1/20 0.35
MAPK1 P28482 1/20 0.35
CYP2C19 P33261 1/20 0.35
HTT P42858 1/20 0.35

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
SCHEMBL896628 0.84 DRD1 (0.43) DRD1IKBKBMAP3K14NOTUM
SCHEMBL895857 0.84 TRPV1 (0.44) DRD1IKBKBMAP3K14
SCHEMBL896357 0.82 DRD1 (0.40) DRD1IKBKBMAP3K14
SCHEMBL12863809 0.82 DRD1 (0.42) DRD1IKBKBMAP3K14ACVR1
SCHEMBL896729 0.81 DRD1 (0.42) DRD1IKBKBMAP3K14NOTUMGAA
SCHEMBL896816 0.79 DRD1 (0.45) DRD1GYS1
SCHEMBL896712 0.79 GRIN2D (0.42) DRD1IKBKBMAP3K14NOTUMMEN1
SCHEMBL896590 0.78 PSD (0.44) DRD1IKBKBMAP3K14NOTUMGAA
SCHEMBL896179 0.78 GRIN2D (0.41) DRD1IKBKBMAP3K14NOTUMMEN1
SCHEMBL2457386 0.77 PTGS1 (0.42) IKBKBMAP3K14NOTUMALPLMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8598176-B2 Pyridazine compound and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-12-03 US disclosed
US-8258136-B2 Pyridazine compound and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-09-04 US disclosed
US-8258136-B2 Pyridazine compound and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-09-04 US disclosed
US-8258136-B2 Pyridazine compound and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-09-04 US disclosed
CN-101326176-B Pyridazine compound and use thereof SUMITOMO CHEMICAL CO 2012-05-30 CN disclosed
US-20120083605-A1 PYRIDAZINE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED 2012-04-05 US disclosed
US-20120083605-A1 PYRIDAZINE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED 2012-04-05 US disclosed
US-20120083605-A1 PYRIDAZINE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED 2012-04-05 US disclosed
EP-1958946-B1 PYRIDAZINE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL CO (JP) 2011-02-23 EP disclosed
EP-1958946-B1 PYRIDAZINE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL CO (JP) 2011-02-23 EP disclosed
US-20100038592-A1 COMPOSITION AND LIGHT-EMITTING ELEMENT COMPRISING THE COMPOSITION SUMATION CO., LTD. (JP) 2010-02-18 US disclosed
US-20100038592-A1 COMPOSITION AND LIGHT-EMITTING ELEMENT COMPRISING THE COMPOSITION SUMATION CO., LTD. (JP) 2010-02-18 US disclosed
US-20090275589-A1 Pyridazine Compound and Use Thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-11-05 US disclosed
US-20090275589-A1 Pyridazine Compound and Use Thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-11-05 US disclosed
US-20090275589-A1 Pyridazine Compound and Use Thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-11-05 US disclosed
EP-2103653-A1 COMPOSITION AND LIGHT-EMITTING ELEMENT COMPRISING THE COMPOSITION Sumitomo Chemical Company, Limited (JP) 2009-09-23 EP disclosed
CN-101326176-A Pyridazine compound and use thereof SUMITOMO CHEMICAL CO (JP) 2008-12-17 CN disclosed
EP-1958946-A1 PYRIDAZINE COMPOUND AND USE THEREOF Sumitomo Chemical Company, Limited (JP) 2008-08-20 EP disclosed
EP-1958946-A1 PYRIDAZINE COMPOUND AND USE THEREOF Sumitomo Chemical Company, Limited (JP) 2008-08-20 EP 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-20120083605-A1 PYRIDAZINE COMPOUND AND USE THEREOF PLPBP, PNPO, PDXK DRD1 2109/4885IKBKB 2953/4885MAP3K14 1151/4885
US-20090275589-A1 Pyridazine Compound and Use Thereof PLPBP, PNPO, PDXK DRD1 2109/4885IKBKB 2953/4885MAP3K14 1151/4885

“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.