SCHEMBL4529502

SCHEMBL4529502

Cc1cc(Cl)nnc1OC(=O)CC(=O)Oc1nnc(Cl)cc1C

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.34
ALDH1A1 P00352 4/20 0.33
KMT2A Q03164 3/20 0.33
HPGD P15428 2/20 0.33
NLRP3 Q96P20 2/20 0.33
MGAM O43451 1/20 0.33
GAA P10253 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 4/20 0.33
MEN1 O00255 2/20 0.33
NPC1 O15118 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
RAB9A P51151 1/20 0.33
TSHR P16473 2/20 0.33
MAPK1 P28482 2/20 0.33
PKM P14618 1/20 0.32

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
SCHEMBL27853643 0.94 GAA (0.46) ALDH1A1KMT2AHPGDNLRP3MGAM
SCHEMBL4529505 0.92 ALDH1A1 (0.33) SYKALDH1A1KMT2AHPGDNLRP3
SCHEMBL27725685 0.85 GAA (0.38) ALDH1A1KMT2AHPGDGAAHTT
SCHEMBL4949836 0.82 KDM4E (0.35) SYKALDH1A1KMT2AHPGDGAA
SCHEMBL27725680 0.75 TDP1 (0.33) ALDH1A1KMT2AHPGDGAAHTT
SCHEMBL29770615 0.71 ALDH1A1 (0.38) ALDH1A1KMT2AHTTMEN1CYP1A2
SCHEMBL16387120 0.71 ALDH1A1 (0.38) ALDH1A1KMT2AHTTMEN1CYP1A2
SCHEMBL31473635 0.68 NPSR1 (0.43) SYKALDH1A1GAAPKMLMNA
SCHEMBL21679164 0.68 NPSR1 (0.43) SYKALDH1A1GAAPKMLMNA
SCHEMBL10132033 0.68 MAPK1 (0.44) ALDH1A1NLRP3SMN1; SMN2RAB9AMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8258136-B2 Pyridazine compound and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-09-04 US disclosed
US-20090275589-A1 Pyridazine Compound and Use Thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-11-05 US 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 (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-20090275589-A1 Pyridazine Compound and Use Thereof PLPBP, PNPO, PDXK SYK 4255/4885ALDH1A1 3397/4885KMT2A 1894/4885

“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.