SCHEMBL2650328

SCHEMBL2650328

COc1ccccc1C(=O)c1cc(C)ccc1NC(=O)Nc1ncc(CNC(=N)N)s1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.46
TP53 P04637 1/20 0.46
PKM P14618 1/20 0.42
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
LMNA P02545 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
MAPT P10636 1/20 0.39
HTT P42858 1/20 0.39
KMT2A Q03164 4/20 0.39
MEN1 O00255 2/20 0.39
ALOX15 P16050 1/20 0.39
HSD17B10 Q99714 1/20 0.39
KCNMA1 Q12791 1/20 0.38
AURKA O14965 1/20 0.38

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
SCHEMBL1497603 0.93 GAA (0.48) GAATP53PKMNPC1RAB9A
SCHEMBL1343466 0.92 TP53 (0.45) GAATP53PKMNPC1RAB9A
SCHEMBL1342685 0.91 TP53 (0.48) GAATP53PKMNPC1RAB9A
SCHEMBL1341790 0.91 TP53 (0.48) GAATP53PKMNPC1RAB9A
SCHEMBL6701130 0.88 TP53 (0.49) GAATP53PKMNPC1RAB9A
SCHEMBL1343039 0.86 TP53 (0.46) GAATP53PKMNPC1RAB9A
SCHEMBL1341110 0.85 TP53 (0.47) GAATP53PKMNPC1RAB9A
SCHEMBL1343104 0.85 TP53 (0.44) GAATP53PKMNPC1RAB9A
SCHEMBL1343075 0.85 TP53 (0.53) GAATP53PKMNPC1RAB9A
SCHEMBL6696280 0.84 TP53 (0.49) GAATP53PKMNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1531815-A1 GLUCOKINASE ACTIVATORS NOVO NORDISK A/S (DK) 2005-05-25 EP disclosed
US-20040122235-A1 Aryl carbonyl derivatives as therapeutic agents VTV THERAPEUTICS LLC 2004-06-24 US disclosed
WO-2004002481-A1 ARYL CARBONYL DERIVATIVES AS THERAPEUTIC AGENTS NOVO NORDISK A/S (DK) 2004-01-08 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-20040122235-A1 Aryl carbonyl derivatives as therapeutic agents GCK, GCKR, PDK2 GAA 48/4885TP53 2961/4885PKM 70/4885

“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.