SCHEMBL6693487

SCHEMBL6693487

COc1ccccc1C(=O)c1cc(C)ccc1NC(=O)Nc1ncc(COc2ccncc2)s1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.47
GAA P10253 1/20 0.47
SMN1; SMN2 Q16637 3/20 0.42
MAPT P10636 3/20 0.42
LMNA P02545 1/20 0.42
HTT P42858 1/20 0.42
KMT2A Q03164 2/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
PKM P14618 1/20 0.40
KDM4E B2RXH2 2/20 0.40
PTPRE P23469 1/20 0.40
MEN1 O00255 1/20 0.40
CDK5 Q00535 1/20 0.39
CDK5R1 Q15078 1/20 0.39
MAPK13 O15264 1/20 0.39
MAPK14 Q16539 1/20 0.39
KCNMA1 Q12791 1/20 0.39
POLB P06746 1/20 0.39
GLA P06280 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
SCHEMBL6701127 0.92 TP53 (0.46) TP53GAASMN1; SMN2MAPTLMNA
SCHEMBL1343945 0.90 TP53 (0.50) TP53GAASMN1; SMN2MAPTLMNA
SCHEMBL6701475 0.88 TP53 (0.46) TP53GAASMN1; SMN2MAPTLMNA
SCHEMBL6696137 0.88 TP53 (0.47) TP53GAASMN1; SMN2MAPTLMNA
SCHEMBL6695518 0.87 TP53 (0.45) TP53GAASMN1; SMN2MAPTLMNA
SCHEMBL1340636 0.87 TP53 (0.45) TP53GAASMN1; SMN2MAPTLMNA
SCHEMBL6695798 0.87 TP53 (0.44) TP53GAASMN1; SMN2MAPTLMNA
SCHEMBL1343075 0.86 TP53 (0.53) TP53GAASMN1; SMN2MAPTLMNA
SCHEMBL6701130 0.85 TP53 (0.49) TP53GAASMN1; SMN2MAPTLMNA
SCHEMBL6696280 0.85 TP53 (0.49) TP53GAASMN1; SMN2MAPTLMNA

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-20040122235-A1 Aryl carbonyl derivatives as therapeutic agents VTV THERAPEUTICS LLC 2004-06-24 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-20040122235-A1 Aryl carbonyl derivatives as therapeutic agents GCK, GCKR, PDK2 TP53 2961/4885GAA 48/4885SMN1; SMN2 2958/4885

“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.