SCHEMBL4535346

SCHEMBL4535346

O=C(O)CC(=O)Oc1nccnc1Cl

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.34
LMNA P02545 1/20 0.34
POLB P06746 1/20 0.33
CHRNB2 P17787 1/20 0.32
CHRNA4 P43681 1/20 0.32
NPC1 O15118 1/20 0.32
ALDH1A1 P00352 1/20 0.32
RAB9A P51151 1/20 0.32
KMT2A Q03164 3/20 0.31
MEN1 O00255 2/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
KCNH2 Q12809 1/20 0.31
GAA P10253 1/20 0.31
CYP19A1 P11511 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
SCHEMBL4535342 0.91 CHRNB2 (0.34) SMN1; SMN2LMNAPOLBCHRNB2CHRNA4
SCHEMBL28794883 0.80 MGAM (0.47) SMN1; SMN2LMNANPC1ALDH1A1KMT2A
SCHEMBL18398770 0.79 LMNA (0.39) SMN1; SMN2LMNAPOLBCHRNB2CHRNA4
SCHEMBL4538158 0.78 MAPK8 (0.43) SMN1; SMN2LMNANPC1ALDH1A1KMT2A
SCHEMBL27746548 0.77 ALDH1A1 (0.38) LMNACHRNB2CHRNA4NPC1ALDH1A1
SCHEMBL2840813 0.76 KMT2A (0.44) SMN1; SMN2LMNACHRNB2CHRNA4ALDH1A1
SCHEMBL31172303 0.76 KMT2A (0.44) SMN1; SMN2LMNACHRNB2CHRNA4ALDH1A1
SCHEMBL11253057 0.75 CHRNB2 (0.36) SMN1; SMN2LMNAPOLBCHRNB2CHRNA4
SCHEMBL7994968 0.74 ATR (0.34) SMN1; SMN2LMNAPOLBCHRNB2CHRNA4
SCHEMBL4944664 0.73 KDM4E (0.39) SMN1; SMN2LMNAPOLBCHRNB2CHRNA4

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 SMN1; SMN2 2463/4885LMNA 2869/4885POLB 3361/4885

“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.