SCHEMBL5633455

SCHEMBL5633455

COc1cc(OC)nc(NC(=O)NS(=O)(=O)c2[nH]cnc2Cl)n1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.55
CYP1A2 P05177 1/20 0.45
CDK1 P06493 1/20 0.44
MAPT P10636 2/20 0.40
TP53 P04637 1/20 0.40
GLA P06280 1/20 0.40
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
USP2 O75604 1/20 0.36
ALDH1A1 P00352 2/20 0.36
KDM4E B2RXH2 1/20 0.36
NPC1 O15118 1/20 0.36
TSHR P16473 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL5634579 0.84 GAA (0.55) GAACYP1A2CDK1MAPTTP53
SCHEMBL5633436 0.83 GAA (0.52) GAACYP1A2CDK1MAPTTP53
SCHEMBL5633964 0.81 GAA (0.52) GAACYP1A2CDK1MAPTTP53
SCHEMBL5792011 0.79 GAA (0.52) GAACYP1A2CDK1MAPTTP53
SCHEMBL9513100 0.76 GAA (0.52) GAACYP1A2CDK1MAPTTP53
SCHEMBL10681053 0.76 GAA (0.57) GAACYP1A2CDK1MAPTTP53
SCHEMBL7800046 0.76 GAA (0.61) GAACYP1A2CDK1MAPTTP53
SCHEMBL8676026 0.74 GAA (0.63) GAACYP1A2CDK1MAPTTP53
SCHEMBL10859355 0.74 GAA (0.63) GAACYP1A2CDK1MAPTTP53
SCHEMBL10616134 0.74 GAA (0.67) GAACYP1A2CDK1MAPTTP53

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-7196196-B2 Substituted imidazo[1, 2-a]-5,6,7,8-tetrahydropyridine-8-ones, method for their production and the use thereof for producing imidazo[1,2-a]pyridines BASF AKTIENGESELLSCHAFT (DE) 2007-03-27 US disclosed
US-20050020620-A1 Substituted imidazo[1, 2-a]-5,6,7,8-tetrahydropyridine-8-ones, method for their production and the use thereof for producing imidazo[1,2-a]pyridines BASF AKTIENGESELLSCHAFT (DE) 2005-01-27 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-20050020620-A1 Substituted imidazo[1, 2-a]-5,6,7,8-tetrahydropyridine-8-ones, method for their production and the use thereof for producing imidazo[1,2-a]pyridines BTN3A1, DHPS, NISCH GAA 2828/4885CYP1A2 43/4885CDK1 1669/4885

“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.