SCHEMBL896839

SCHEMBL896839

COc1cnc(-c2c(Cl)nnc(C)c2-c2ccc(Cl)cc2)c(Cl)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.40
MEN1 O00255 5/20 0.40
NPSR1 Q6W5P4 3/20 0.40
ALOX12 P18054 3/20 0.40
CNR1 P21554 2/20 0.40
CNR2 P34972 2/20 0.40
GPR55 Q9Y2T6 2/20 0.40
MAPT P10636 2/20 0.40
KDM4E B2RXH2 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
HSP90AA1 P07900 1/20 0.36
ALOX15 P16050 2/20 0.35
CACNA2D1 P54289 1/20 0.35
LMNA P02545 1/20 0.35
TP53 P04637 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
SCHEMBL12332925 0.90 MEN1 (0.40) KMT2AMEN1NPSR1ALOX12CNR1
SCHEMBL896318 0.85 CNR2 (0.37) KMT2AMEN1NPSR1CNR2MAPT
SCHEMBL15886449 0.85 CACNA2D1 (0.40) MAPTTDP1CACNA2D1TP53GAA
SCHEMBL13092765 0.82 KMT2A (0.37) KMT2AMEN1NPSR1ALOX12CNR1
SCHEMBL15886463 0.80 GRIN1 (0.45) KMT2AMEN1NPSR1MAPTKDM4E
SCHEMBL10131946 0.79 KDM4E (0.36) KMT2AMAPTKDM4ECACNA2D1ATM
SCHEMBL896645 0.79 MAPT (0.45) KMT2AMEN1NPSR1ALOX12CNR1
SCHEMBL3576141 0.77 CYP2C9 (0.38) KMT2AMEN1NPSR1ALOX12CNR1
SCHEMBL10000738 0.77 CNR2 (0.35) KMT2AMEN1CNR2KDM4ECACNA2D1
SCHEMBL896631 0.76 PTGS2 (0.36) KMT2AMEN1MAPTKDM4ECACNA2D1

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 75 patents — showing the first 20. 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-8410026-B2 Pyridazine fungicides SYNGENTA CROP PROTECTION LLC (US) 2013-04-02 US disclosed
US-8410026-B2 Pyridazine fungicides SYNGENTA CROP PROTECTION LLC (US) 2013-04-02 US disclosed
US-8410026-B2 Pyridazine fungicides SYNGENTA CROP PROTECTION LLC (US) 2013-04-02 US disclosed
EP-2231637-B1 PYRIDAZINE FUNGICIDES SYNGENTA PARTICIPATIONS AG (CH) 2012-12-19 EP disclosed
EP-2231637-B1 PYRIDAZINE FUNGICIDES SYNGENTA PARTICIPATIONS AG (CH) 2012-12-19 EP 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
US-20120083605-A1 PYRIDAZINE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED 2012-04-05 US disclosed
EP-2049521-A2 NOVEL PYRIDAZINE DERIVATIVES Syngeta Participations AG (CH) 2009-04-22 EP 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
WO-2008089934-A1 PYRIDAZINE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND THEIR USE AS FUNGICIDES SYNGENTA PARTICIPATIONS AG (CH) 2008-07-31 WO disclosed
WO-2008089934-A1 PYRIDAZINE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND THEIR USE AS FUNGICIDES SYNGENTA PARTICIPATIONS AG (CH) 2008-07-31 WO disclosed
WO-2008049585-A1 PYRIDAZINE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2008-05-02 WO disclosed
WO-2008049585-A1 PYRIDAZINE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2008-05-02 WO disclosed
WO-2008049584-A1 NOVEL PYRIDAZINE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2008-05-02 WO disclosed
WO-2008009405-A2 NOVEL PYRIDAZINE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2008-01-24 WO disclosed
WO-2008009405-A2 NOVEL PYRIDAZINE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2008-01-24 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-20120083605-A1 PYRIDAZINE COMPOUND AND USE THEREOF PLPBP, PNPO, PDXK KMT2A 1894/4885MEN1 3015/4885NPSR1 2976/4885

“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.