SCHEMBL16017808

SCHEMBL16017808

COC(=O)c1c(NC(=O)c2ccc(Cl)nc2NC2CCN(Cc3ccccc3)CC2)sc2c1CCN(C(=O)OC(C)(C)C)C2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.45
TP53 P04637 2/20 0.45
KDM4E B2RXH2 2/20 0.45
LMNA P02545 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
NT5E P21589 1/20 0.44
KMT2A Q03164 3/20 0.43
NPSR1 Q6W5P4 2/20 0.43
MEN1 O00255 2/20 0.43
MAPT P10636 1/20 0.43
CASP1 P29466 1/20 0.43
CASP7 P55210 1/20 0.43
ADORA3 P0DMS8 1/20 0.43
PDE4D Q08499 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
RORC P51449 1/20 0.42
PKM P14618 1/20 0.42
RXFP1 Q9HBX9 1/20 0.41
SLC6A12 P48065 1/20 0.41
GAA P10253 1/20 0.41

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
SCHEMBL16007649 0.84 SLC6A12 (0.44) ALDH1A1TP53KDM4ELMNASMN1; SMN2
SCHEMBL16017751 0.82 PDE4D (0.54) ALDH1A1TP53KDM4ELMNASMN1; SMN2
SCHEMBL16007457 0.82 ALDH1A1 (0.50) ALDH1A1TP53KDM4ELMNASMN1; SMN2
SCHEMBL16007443 0.79 LMNA (0.54) ALDH1A1TP53KDM4ELMNASMN1; SMN2
SCHEMBL13738440 0.78 ALDH1A1 (0.52) ALDH1A1TP53KDM4ELMNASMN1; SMN2
SCHEMBL16007346 0.75 HPGD (0.51) ALDH1A1TP53KDM4ELMNASMN1; SMN2
SCHEMBL16007494 0.74 RORC (0.46) ALDH1A1TP53KDM4ELMNASMN1; SMN2
SCHEMBL16007166 0.74 RAB9A (0.39) ALDH1A1TP53KDM4EKMT2AMEN1
SCHEMBL16017760 0.74 RORC (0.46) ALDH1A1TP53KDM4ELMNASMN1; SMN2
SCHEMBL16007605 0.73 LMNA (0.46) ALDH1A1TP53KDM4ELMNASMN1; SMN2

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 4 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-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 ALDH1A1 1208/4885TP53 2955/4885KDM4E 3719/4885

“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.