SCHEMBL3604528

SCHEMBL3604528

Cc1nnc(Cl)c(-c2ncc(Cl)cc2Cl)c1-c1ccc(Cl)nc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.38
NPC1 O15118 3/20 0.34
PTGS2 P35354 6/20 0.33
PTGS1 P23219 3/20 0.33
CRHR1 P34998 3/20 0.33
ABCC4 O15439 1/20 0.33
ABCB11 O95342 1/20 0.33
PDE4D Q08499 1/20 0.33
MAPK14 Q16539 1/20 0.33
PIK3CD O00329 1/20 0.33
NOTUM Q6P988 1/20 0.33
RAB9A P51151 2/20 0.32
CYP2A6 P11509 1/20 0.32
PDE10A Q9Y233 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
KDR P35968 1/20 0.31
ETV6 P41212 1/20 0.31
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL3609800 0.90 PTGS2 (0.43) CNR2PTGS2PTGS1CRHR1ABCC4
SCHEMBL896318 0.88 CNR2 (0.37) CNR2NPC1PTGS2PTGS1CRHR1
SCHEMBL3616326 0.85 MEN1 (0.36) CNR2NPC1PTGS2PTGS1CRHR1
SCHEMBL10000738 0.84 CNR2 (0.35) CNR2NPC1PTGS2PTGS1CRHR1
SCHEMBL10000761 0.84 MAOB (0.40) CNR2PTGS2PTGS1CRHR1KMT2A
SCHEMBL3619780 0.83 IDO1 (0.37) CNR2PTGS2PTGS1CRHR1ABCC4
SCHEMBL3569381 0.78 CNR2 (0.42) CNR2PTGS2PTGS1NOTUMKDM4E
SCHEMBL10000192 0.77 CNR2 (0.37) CNR2NPC1PTGS2PTGS1CRHR1
SCHEMBL15886463 0.77 GRIN1 (0.45) MEN1KMT2AKDM4E
SCHEMBL13092765 0.76 KMT2A (0.37) CNR2MEN1KMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100029668-A1 NOVEL PYRIDAZINE DERIVATIVES SYNGENTA CROP PROTECTION, INC. (US) 2010-02-04 US claimed
EP-2049521-A2 NOVEL PYRIDAZINE DERIVATIVES Syngeta Participations AG (CH) 2009-04-22 EP claimed
WO-2008009405-A2 NOVEL PYRIDAZINE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2008-01-24 WO claimed
US-20100029668-A1 NOVEL PYRIDAZINE DERIVATIVES SYNGENTA CROP PROTECTION, INC. (US) 2010-02-04 US disclosed
EP-2049521-A2 NOVEL PYRIDAZINE DERIVATIVES Syngeta Participations AG (CH) 2009-04-22 EP 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-20100029668-A1 NOVEL PYRIDAZINE DERIVATIVES C3AR1, C5, C1S CNR2 215/4885NPC1 2554/4885PTGS2 2167/4885

“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.