SCHEMBL12435554

SCHEMBL12435554

COC(=O)c1ccc(NC(=N)c2cccs2)c(OC)c1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.55
SMN1; SMN2 Q16637 4/20 0.55
GAA P10253 2/20 0.55
RAB9A P51151 3/20 0.54
APLNR P35414 1/20 0.51
KMT2A Q03164 4/20 0.51
KDM4E B2RXH2 3/20 0.51
MEN1 O00255 3/20 0.51
ALDH1A1 P00352 3/20 0.51
CYP3A4 P08684 1/20 0.50
CYP2C19 P33261 1/20 0.50
LMNA P02545 4/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
POLB P06746 1/20 0.48
PYGL P06737 1/20 0.47
PTBP1 P26599 1/20 0.47
NPC1 O15118 1/20 0.47
TSHR P16473 1/20 0.47
HSD17B10 Q99714 1/20 0.47

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
Hydrochloric Acid SCHEMBL1580048 0.99 MAPT (0.54) MAPTSMN1; SMN2GAARAB9AAPLNR
SCHEMBL1579974 0.90 KMT2A (0.53) MAPTSMN1; SMN2GAARAB9AAPLNR
Hydrochloric Acid SCHEMBL1579944 0.89 LMNA (0.57) MAPTSMN1; SMN2GAARAB9AAPLNR
SCHEMBL12388558 0.87 MAPT (0.52) MAPTSMN1; SMN2GAARAB9AAPLNR
SCHEMBL12388570 0.83 MAPK14 (0.51) MAPTSMN1; SMN2RAB9AKMT2AKDM4E
Hydrochloric Acid SCHEMBL1579990 0.82 MAPK14 (0.50) MAPTSMN1; SMN2RAB9AKMT2AKDM4E
SCHEMBL7570783 0.78 KMT2A (0.58) MAPTSMN1; SMN2GAARAB9AKMT2A
SCHEMBL1579925 0.78 KMT2A (0.68) MAPTSMN1; SMN2GAARAB9AAPLNR
SCHEMBL7132994 0.75 APLNR (0.63) MAPTSMN1; SMN2RAB9AAPLNRKMT2A
SCHEMBL15693330 0.74 ALDH1A1 (0.62) MAPTSMN1; SMN2RAB9AKMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110190351-A1 Benzoimidazole Derivatives and Glycogen Synthase Kinase-3 Beta Inhibitors Containing the Same ONCOTHERAPY SCIENCE, INC. (JP) 2011-08-04 US disclosed
WO-2010014794-A1 BENZOIMIDAZOLE DERIVATIVES AND GLYCOGEN SYNTHASE KINASE-3 BETA INHIBITORS CONTAINING THE SAME ONCOTHERAPY SCIENCE, INC. (JP) 2010-02-04 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-20110190351-A1 Benzoimidazole Derivatives and Glycogen Synthase Kinase-3 Beta Inhibitors Containing the Same GSK3B, GSK3A, GYS2 MAPT 1213/4885SMN1; SMN2 3707/4885GAA 107/4885

“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.