SCHEMBL6692815

SCHEMBL6692815

COc1ccc(NC(=O)C(=O)Nc2nc(CNS(C)(=O)=O)cs2)c(C(=O)C2CCCC2)c1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AVPR1B P47901 4/20 0.42
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
LMNA P02545 2/20 0.40
HTT P42858 1/20 0.40
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
PDE5A O76074 2/20 0.37
KCNQ1 P51787 1/20 0.37
MAPT P10636 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
SCHEMBL1343080 0.89 RAB9A (0.38) MEN1KMT2ANPC1RAB9ALMNA
SCHEMBL1342825 0.87 RAB9A (0.45) AVPR1BMEN1KMT2ANPC1RAB9A
SCHEMBL5904379 0.84 MAPT (0.36) MEN1KMT2ANPC1RAB9AALDH1A1
SCHEMBL5904340 0.83 DYRK1A (0.37) MEN1KMT2ANPC1RAB9ALMNA
SCHEMBL6696138 0.83 MAPT (0.36) MEN1KMT2ANPC1RAB9AALDH1A1
SCHEMBL5904383 0.83 MEN1 (0.37) MEN1KMT2ANPC1RAB9AALDH1A1
SCHEMBL1342591 0.81 SMN1; SMN2 (0.39) MEN1KMT2ANPC1RAB9ALMNA
SCHEMBL1339659 0.79 MAPT (0.47) AVPR1BMEN1KMT2ANPC1RAB9A
SCHEMBL1343156 0.79 RAB9A (0.44) MEN1KMT2ANPC1RAB9ALMNA
SCHEMBL1341889 0.77 MAPT (0.41) MEN1KMT2ANPC1RAB9AHTT

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 AVPR1B 4744/4885MEN1 4426/4885KMT2A 1526/4885

“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.