SCHEMBL6695568

SCHEMBL6695568

Cc1ccc(NC(=O)Nc2ncc(C(=O)Nc3nc(C(=O)O)c[nH]3)s2)c(N2CCCCC2)c1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.40
MAPT P10636 2/20 0.38
TP53 P04637 1/20 0.38
PIM1 P11309 2/20 0.37
PIM3 Q86V86 2/20 0.37
KDR P35968 1/20 0.37
DHODH Q02127 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HPGD P15428 1/20 0.35
PRNP P04156 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
LCK P06239 1/20 0.35
PIM2 Q9P1W9 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
SCHEMBL1340668 0.85 POLB (0.39) POLBMAPTTP53PIM1PIM3
SCHEMBL1343250 0.85 POLB (0.40) POLBMAPTTP53PIM1PIM3
SCHEMBL1343201 0.85 POLB (0.48) POLBMAPTTP53DHODHNPSR1
SCHEMBL1343273 0.85 MAPT (0.40) POLBMAPTTP53PIM1PIM3
SCHEMBL1343212 0.84 MAPT (0.41) POLBMAPTTP53PIM1PIM3
SCHEMBL1341143 0.83 POLB (0.46) POLBMAPTTP53PIM1PIM3
SCHEMBL1342394 0.83 POLB (0.42) POLBMAPTTP53DHODHNPSR1
SCHEMBL1340705 0.83 POLB (0.39) POLBMAPTTP53PIM1PIM3
SCHEMBL1343260 0.82 POLB (0.39) POLBMAPTTP53PIM1PIM3
SCHEMBL6700182 0.82 LCK (0.40) KMT2ALCK

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 POLB 3676/4885MAPT 2678/4885TP53 2961/4885

“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.