SCHEMBL3490263

SCHEMBL3490263

CSc1ccc(-c2csc3ccc(C(=O)NN)cc23)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
GAA P10253 2/20 0.39
LMNA P02545 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HAO1 Q9UJM8 1/20 0.39
PLK1 P53350 1/20 0.39
MAPK14 Q16539 1/20 0.39
HDAC2 Q92769 1/20 0.38
L3MBTL1 Q9Y468 3/20 0.37
MAPT P10636 2/20 0.37
POLB P06746 1/20 0.36
HPGD P15428 1/20 0.36
BLM P54132 1/20 0.36
CTDSP1 Q9GZU7 1/20 0.36
UBE2N P61088 1/20 0.36
TAS1R3 Q7RTX0 1/20 0.36
TAS1R1 Q7RTX1 1/20 0.36
GSK3B P49841 1/20 0.35
PTGS2 P35354 1/20 0.34
EPHX2 P34913 1/20 0.34

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
SCHEMBL3490994 0.84 L3MBTL1 (0.46) ALDH1A1GAALMNASMN1; SMN2HAO1
SCHEMBL3491848 0.76 GSK3B (0.52) ALDH1A1GAALMNASMN1; SMN2HAO1
SCHEMBL2830827 0.73 PLK1 (0.68) ALDH1A1GAALMNASMN1; SMN2HAO1
SCHEMBL12365936 0.70 NPC1 (0.47) ALDH1A1GAASMN1; SMN2MAPTPOLB
SCHEMBL2815532 0.69 CA1 (0.50) ALDH1A1GAALMNASMN1; SMN2MAPT
SCHEMBL12365931 0.69 MAPT (0.52) ALDH1A1LMNASMN1; SMN2L3MBTL1MAPT
SCHEMBL3490770 0.69 GSK3B (0.37) ALDH1A1GAALMNASMN1; SMN2HAO1
SCHEMBL12389733 0.68 CA1 (0.51) ALDH1A1L3MBTL1MAPTTDP1
SCHEMBL12365933 0.68 PTGS1 (0.55) ALDH1A1GAALMNASMN1; SMN2MAPT
SCHEMBL12365265 0.67 KDM4E (0.44) ALDH1A1GAALMNASMN1; SMN2HDAC2

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-8492378-B2 GSK-3β inhibitor TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-07-23 US disclosed
US-20100069381-A1 GSK-3BETAINHIBITOR TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-03-18 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-20100069381-A1 GSK-3BETAINHIBITOR GSK3B, GSK3A, GSKIP ALDH1A1 1473/4885GAA 1403/4885LMNA 1441/4885

“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.