SCHEMBL16007346

SCHEMBL16007346

COC(=O)c1c(NC(=O)c2cccnc2Cl)sc2c1CCN(C(=O)OC(C)(C)C)C2

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.51
POLB P06746 1/20 0.50
ALDH1A1 P00352 4/20 0.49
NPSR1 Q6W5P4 3/20 0.49
MAPT P10636 3/20 0.49
TP53 P04637 3/20 0.49
CASP1 P29466 2/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
CASP7 P55210 1/20 0.49
KDM4E B2RXH2 4/20 0.47
HSD17B10 Q99714 3/20 0.47
MKNK1 Q9BUB5 3/20 0.47
LMNA P02545 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
ALOX12 P18054 1/20 0.47
HTT P42858 1/20 0.47
GAA P10253 1/20 0.47
RXFP1 Q9HBX9 1/20 0.46
ADORA1 P30542 2/20 0.45

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
SCHEMBL13738440 0.88 ALDH1A1 (0.52) HPGDALDH1A1NPSR1MAPTTP53
SCHEMBL16007457 0.87 ALDH1A1 (0.50) HPGDALDH1A1NPSR1MAPTTP53
SCHEMBL16007470 0.83 ALDH1A1 (0.49) HPGDALDH1A1NPSR1MAPTTP53
SCHEMBL13738138 0.79 NPC1 (0.61) HPGDPOLBALDH1A1NPSR1MAPT
SCHEMBL13833844 0.79 ALDH1A1 (0.62) HPGDALDH1A1NPSR1MAPTTP53
SCHEMBL21260643 0.77 MEN1 (0.62) HPGDALDH1A1NPSR1MAPTTP53
SCHEMBL16450569 0.77 KMT2A (0.54) HPGDPOLBALDH1A1NPSR1MAPT
SCHEMBL13739687 0.76 TP53 (0.57) HPGDALDH1A1NPSR1MAPTTP53
SCHEMBL16017808 0.75 ALDH1A1 (0.45) ALDH1A1NPSR1MAPTTP53CASP1
SCHEMBL19475094 0.74 PDE4D (0.66) HPGDALDH1A1NPSR1MAPTTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9227955-B2 Compound having angiogenesis inhibitory activity, method for preparing same, and pharmaceutical composition comprising same BORYUNG PHARMACEUTICAL CO., LTD. (KR) 2016-01-05 US disclosed
US-9227955-B2 Compound having angiogenesis inhibitory activity, method for preparing same, and pharmaceutical composition comprising same BORYUNG PHARMACEUTICAL CO., LTD. (KR) 2016-01-05 US disclosed
US-9227955-B2 Compound having angiogenesis inhibitory activity, method for preparing same, and pharmaceutical composition comprising same BORYUNG PHARMACEUTICAL CO., LTD. (KR) 2016-01-05 US disclosed
US-20140256711-A1 Novel Compound Having Angiogenesis Inhibitory Activity, Method for Preparing Same, and Pharmaceutical Composition Comprising Same BORYUNG PHARMACEUTICAL CO., LTD. (KR) 2014-09-11 US disclosed
US-20140256711-A1 Novel Compound Having Angiogenesis Inhibitory Activity, Method for Preparing Same, and Pharmaceutical Composition Comprising Same BORYUNG PHARMACEUTICAL CO., LTD. (KR) 2014-09-11 US disclosed
US-20140256711-A1 Novel Compound Having Angiogenesis Inhibitory Activity, Method for Preparing Same, and Pharmaceutical Composition Comprising Same BORYUNG PHARMACEUTICAL CO., LTD. (KR) 2014-09-11 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-20140256711-A1 Novel Compound Having Angiogenesis Inhibitory Activity, Method for Preparing Same, and Pharmaceutical Composition Comprising Same VEGFA, EDF1, FLT1 HPGD 1047/4885POLB 3410/4885ALDH1A1 1208/4885

“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.