SCHEMBL4493393

SCHEMBL4493393

COC(=O)c1sccc1NC(=O)OCc1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 3/20 0.68
MAPK10 P53779 3/20 0.68
MAPK9 P45984 2/20 0.68
L3MBTL1 Q9Y468 3/20 0.61
LMNA P02545 2/20 0.57
CASP3 P42574 1/20 0.57
NPC1 O15118 2/20 0.57
RAB9A P51151 1/20 0.57
KDM4E B2RXH2 2/20 0.56
MAPK1 P28482 1/20 0.56
HSD17B10 Q99714 1/20 0.56
ALDH1A1 P00352 2/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
MAPT P10636 1/20 0.54
HPGD P15428 1/20 0.54
NPSR1 Q6W5P4 1/20 0.53

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
SCHEMBL4507572 0.88 CASP3 (0.60) MAPK8MAPK10MAPK9CASP3NPC1
SCHEMBL2802258 0.82 HPGD (0.62) MAPK8MAPK10MAPK9L3MBTL1LMNA
SCHEMBL1039299 0.81 MAPK8 (1.00) MAPK8MAPK10MAPK9L3MBTL1LMNA
SCHEMBL15880510 0.80 L3MBTL1 (0.66) MAPK8MAPK10MAPK9L3MBTL1LMNA
SCHEMBL25717208 0.80 MAPK8 (0.54) MAPK8MAPK10MAPK9L3MBTL1LMNA
SCHEMBL10874779 0.79 NPC1 (0.68) MAPK10L3MBTL1LMNANPC1RAB9A
SCHEMBL4154187 0.78 MAPK8 (0.67) MAPK8MAPK10MAPK9L3MBTL1LMNA
SCHEMBL4779529 0.77 ALDH1A1 (0.60) MAPK8MAPK10MAPK9L3MBTL1LMNA
SCHEMBL3555247 0.77 NPC1 (0.58) LMNACASP3NPC1RAB9AMAPK1
SCHEMBL3244736 0.77 RAF1 (0.64) L3MBTL1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090325956-A1 Aromatic amine derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-12-31 US 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-20090325956-A1 Aromatic amine derivative and use thereof SCD, SCD5, SMS MAPK8 2493/4885MAPK10 1547/4885MAPK9 2149/4885

“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.