SCHEMBL2260994

SCHEMBL2260994

NC(=O)c1cccc(NC(=O)c2cc(Cl)nnc2Cl)c1N

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.57
▸ RAB9A P51151 4/20 0.57
▸ L3MBTL1 Q9Y468 2/20 0.57
▸ LMNA P02545 2/20 0.43
▸ CASP1 P29466 3/20 0.41
▸ KDM4E B2RXH2 5/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ CYP1A2 P05177 2/20 0.39
▸ CYP2C19 P33261 2/20 0.39
▸ HPGD P15428 1/20 0.39
▸ NPC1 O15118 3/20 0.39
▸ PLK4 O00444 1/20 0.38
▸ AURKA O14965 1/20 0.38
▸ DAPK3 O43293 1/20 0.38
▸ CHEK2 O96017 1/20 0.38
▸ NTRK1 P04629 1/20 0.38
▸ CDK1 P06493 1/20 0.38
▸ PIM1 P11309 1/20 0.38
▸ FGFR1 P11362 1/20 0.38

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
SCHEMBL2374088 0.76 ALDH1A1 (0.61) ALDH1A1RAB9AL3MBTL1LMNACASP1
SCHEMBL669037 0.73 CASP1 (0.56) ALDH1A1RAB9AL3MBTL1LMNACASP1
SCHEMBL5739272 0.72 ALDH1A1 (0.54) ALDH1A1RAB9AL3MBTL1LMNACASP1
SCHEMBL10932638 0.72 ALDH1A1 (0.67) ALDH1A1RAB9AL3MBTL1LMNAKDM4E
SCHEMBL5740765 0.70 ALDH1A1 (0.63) ALDH1A1RAB9AL3MBTL1LMNACASP1
SCHEMBL5739260 0.70 RORC (0.57) ALDH1A1RAB9AL3MBTL1LMNACASP1
SCHEMBL16853382 0.69 SYK (0.41) ALDH1A1RAB9AL3MBTL1LMNACASP1
SCHEMBL656835 0.67 MAPK1 (0.52) ALDH1A1L3MBTL1LMNAKDM4EMEN1
SCHEMBL2087189 0.67 ALDH1A1 (1.00) ALDH1A1RAB9AL3MBTL1LMNAKDM4E
SCHEMBL15687877 0.66 CASP1 (0.58) ALDH1A1RAB9AL3MBTL1LMNACASP1

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-7994160-B2 Pyridazine compounds as glycogen synthase kinase 3 inhibitors ABBOTT GMBH & CO. KG (DE) 2011-08-09 — — US disclosed
US-7994160-B2 Pyridazine compounds as glycogen synthase kinase 3 inhibitors ABBOTT GMBH & CO. KG (DE) 2011-08-09 — — US disclosed
US-7994160-B2 Pyridazine compounds as glycogen synthase kinase 3 inhibitors ABBOTT GMBH & CO. KG (DE) 2011-08-09 — — US disclosed
US-20090325937-A1 Pyridazine Compounds as Glycogen Synthase Kinase 3 Inhibitors ABBOTT GMBH & CO. KG (DE) 2009-12-31 — — US disclosed
US-20090325937-A1 Pyridazine Compounds as Glycogen Synthase Kinase 3 Inhibitors ABBOTT GMBH & CO. KG (DE) 2009-12-31 — — US disclosed
WO-2007006566-A1 PYRIDAZINE COMPOUNDS AS GLYCOGEN SYNTHASE KINASE 3 INHIBITORS ABBOTT GMBH & CO. KG (DE) 2007-01-18 — — 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-20090325937-A1 Pyridazine Compounds as Glycogen Synthase Kinase 3 Inhibitors GSK3B, GSK3A, GYS2 ALDH1A1 3577/4885RAB9A 4333/4885L3MBTL1 2882/4885

“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.

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