SCHEMBL4538155

SCHEMBL4538155

O=C(CC(=O)Oc1ncccc1Cl)Oc1ncccc1Cl

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.44
MAPK8 P45983 3/20 0.43
HTT P42858 2/20 0.41
SSTR4 P31391 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ALDH1A1 P00352 3/20 0.41
NPC1 O15118 2/20 0.40
TSHR P16473 1/20 0.40
CASP3 P42574 2/20 0.40
SENP8 Q96LD8 2/20 0.40
SENP7 Q9BQF6 2/20 0.40
SENP6 Q9GZR1 2/20 0.40
KDM4E B2RXH2 2/20 0.40
RAB9A P51151 1/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
LMNA P02545 1/20 0.39
TP53 P04637 1/20 0.39

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
SCHEMBL4538158 0.92 MAPK8 (0.43) GAAMAPK8HTTSSTR4SMN1; SMN2
SCHEMBL27870438 0.89 GAA (0.46) GAAHTTALDH1A1NPC1TSHR
SCHEMBL27746520 0.83 GAA (0.43) GAAHTTSSTR4ALDH1A1NPC1
SCHEMBL10448630 0.81 SMN1; SMN2 (0.44) GAAMAPK8HTTSSTR4SMN1; SMN2
SCHEMBL28793465 0.80 RAB9A (0.46) GAAMAPK8HTTSSTR4SMN1; SMN2
SCHEMBL4945566 0.80 KDM4E (0.54) GAAMAPK8HTTSSTR4SMN1; SMN2
SCHEMBL4537895 0.79 L3MBTL1 (0.46) MAPK8HTTSSTR4ALDH1A1NPC1
SCHEMBL20293665 0.77 RAB9A (0.44) GAAMAPK8HTTSSTR4SMN1; SMN2
SCHEMBL27712539 0.76 LMNA (0.51) MAPK8HTTSMN1; SMN2ALDH1A1NPC1
SCHEMBL4535342 0.76 CHRNB2 (0.34) GAAHTTSMN1; SMN2ALDH1A1NPC1

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 GAA 1580/4885MAPK8 2147/4885HTT 2390/4885

“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.