SCHEMBL6695798

SCHEMBL6695798

COc1ccccc1C(=O)c1cc(C)ccc1NC(=O)Nc1ncc(CS(=O)(=O)c2ccncc2)s1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.44
GAA P10253 1/20 0.44
RXFP1 Q9HBX9 1/20 0.39
KMT2A Q03164 2/20 0.39
MAPK13 O15264 3/20 0.38
MAPK14 Q16539 3/20 0.38
PKM P14618 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
KDM4E B2RXH2 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
HTT P42858 1/20 0.38
POLB P06746 1/20 0.38
MEN1 O00255 1/20 0.38
CDK5 Q00535 1/20 0.37
CDK5R1 Q15078 1/20 0.37

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
SCHEMBL1343298 0.92 TP53 (0.43) TP53GAARXFP1KMT2APKM
SCHEMBL1341673 0.91 TP53 (0.47) TP53GAARXFP1KMT2ANPC1
SCHEMBL1341845 0.89 PTGDR2 (0.46) TP53GAAKMT2ANPC1RAB9A
SCHEMBL1343405 0.89 TP53 (0.44) TP53GAARXFP1KMT2APKM
SCHEMBL1343346 0.88 TP53 (0.43) TP53GAAKMT2ANPC1SMN1; SMN2
SCHEMBL6693487 0.87 TP53 (0.47) TP53GAAKMT2AMAPK13MAPK14
SCHEMBL1340800 0.87 TP53 (0.42) TP53GAARXFP1KMT2APKM
SCHEMBL1342124 0.86 TP53 (0.42) TP53GAARXFP1KMT2APKM
SCHEMBL1342811 0.86 TP53 (0.46) TP53GAARXFP1KMT2APKM
SCHEMBL6695518 0.85 TP53 (0.45) TP53GAAKMT2AMAPK13MAPK14

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 48/4885RXFP1 3757/4885

“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.