SCHEMBL3426316

SCHEMBL3426316

COc1nnc(-c2cc(C)c(O)c(C)c2)cc1-c1[nH]c2cc(CN3CCN(C)CC3)ccc2c1-c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 1/20 0.47
KDR P35968 5/20 0.40
FGFR1 P11362 2/20 0.39
FLT1 P17948 1/20 0.39
TLR8 Q9NR97 2/20 0.38
TLR7 Q9NYK1 2/20 0.38
TLR9 Q9NR96 1/20 0.37
POLB P06746 1/20 0.37
AXL P30530 1/20 0.37
MERTK Q12866 1/20 0.37
PDGFRB P09619 1/20 0.36
PARP1 P09874 3/20 0.36
GRIN2B Q13224 1/20 0.36
TNIK Q9UKE5 1/20 0.36
KCNH2 Q12809 1/20 0.36
PARP2 Q9UGN5 1/20 0.36
ACP1 P24666 1/20 0.36
JAK2 O60674 1/20 0.35
INSR P06213 1/20 0.35
IGF1R P08069 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
SCHEMBL3427361 0.88 GSK3B (0.49) GSK3BKDRFGFR1FLT1TLR8
SCHEMBL3426898 0.84 GSK3B (0.65) GSK3BKDRFGFR1FLT1POLB
SCHEMBL3428325 0.80 CHEK1 (0.42) PARP1ACP1CHEK1
SCHEMBL3427546 0.77 TLR8 (0.40) KDRFGFR1FLT1TLR8TLR7
SCHEMBL3427791 0.75 PARP1 (0.39) KDRFGFR1FLT1TLR8TLR7
SCHEMBL3426532 0.74 TLR7 (0.46) KDRFGFR1FLT1TLR8TLR7
SCHEMBL3427264 0.71 GSK3B (0.48) GSK3BKDRFGFR1FLT1POLB
SCHEMBL1749941 0.71 ALOX5 (0.50)
SCHEMBL3425635 0.69 ALOX5 (0.43) GSK3B
SCHEMBL3427929 0.68 GSK3B (0.42) GSK3BAXLMERTKPARP1MET

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1753743-B1 PYRIDAZINONE DERIVATIVES, METHODS FOR PRODUCING THEM AND THEIR USE AS PHARMACEUTICALS SANOFI AVENTIS DEUTSCHLAND (DE) 2015-03-04 EP disclosed
US-7709466-B2 Pyridazinone derivatives, methods for their production and their use as pharmaceuticals SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2010-05-04 US disclosed
US-20070088041-A1 PYRIDAZINONE DERIVATIVES, METHODS FOR THEIR PRODUCTION AND THEIR USE AS PHARMACEUTICALS SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-04-19 US disclosed
EP-1753743-A1 PYRIDAZINONE DERIVATIVES, METHODS FOR PRODUCING THEM AND THEIR USE AS PHARMACEUTICALS Sanofi-Aventis Deutschland GmbH (DE) 2007-02-21 EP disclosed
WO-2005111018-A1 PYRIDAZINONE DERIVATIVES, METHODS FOR PRODUCING THEM AND THEIR USE AS PHARMACEUTICALS SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2005-11-24 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-20070088041-A1 PYRIDAZINONE DERIVATIVES, METHODS FOR THEIR PRODUCTION AND THEIR USE AS PHARMACEUTICALS GSK3B, GSK3A, PDXK GSK3B 1/4885KDR 1907/4885FGFR1 1444/4885

“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.