SCHEMBL16017751

SCHEMBL16017751

CCOC(=O)N1CCc2c(sc(NC(=O)c3cccnc3NC3CCN(Cc4ccccc4)CC3)c2C(=O)OC)C1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 3/20 0.54
ADORA3 P0DMS8 1/20 0.54
NPSR1 Q6W5P4 3/20 0.51
KMT2A Q03164 3/20 0.51
RXFP1 Q9HBX9 1/20 0.51
LMNA P02545 6/20 0.51
SMN1; SMN2 Q16637 5/20 0.51
HTT P42858 2/20 0.51
ABCB1 P08183 1/20 0.51
ABCG2 Q9UNQ0 1/20 0.51
ALDH1A1 P00352 6/20 0.49
KDM4E B2RXH2 4/20 0.49
HPGD P15428 3/20 0.49
HSD17B10 Q99714 2/20 0.49
ALOX12 P18054 1/20 0.49
CASP1 P29466 1/20 0.49
MEN1 O00255 2/20 0.47
THRB P10828 1/20 0.46
TP53 P04637 2/20 0.46
MAPK1 P28482 1/20 0.46

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
SCHEMBL16007443 0.91 LMNA (0.54) KMT2ALMNASMN1; SMN2HTTABCB1
SCHEMBL16007605 0.87 LMNA (0.46) KMT2ALMNASMN1; SMN2HTTABCB1
SCHEMBL16007494 0.85 RORC (0.46) LMNASMN1; SMN2HTTABCB1ABCG2
SCHEMBL16017808 0.82 ALDH1A1 (0.45) PDE4DADORA3NPSR1KMT2ARXFP1
SCHEMBL16017734 0.80 KDM4E (0.41) NPSR1KMT2AALDH1A1KDM4EHSD17B10
SCHEMBL16007500 0.78 RORC (0.44) LMNASMN1; SMN2HTTABCB1ABCG2
SCHEMBL16007649 0.76 SLC6A12 (0.44) KMT2ALMNASMN1; SMN2ALDH1A1KDM4E
SCHEMBL16007789 0.75 TP53 (0.41) KMT2ALMNASMN1; SMN2HTTALDH1A1
SCHEMBL16007664 0.74 POLB (0.59) KMT2ARXFP1LMNASMN1; SMN2HTT
SCHEMBL16007808 0.73 ALDH1A1 (0.49) KMT2ARXFP1LMNASMN1; SMN2HTT

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 PDE4D 1081/4885ADORA3 4115/4885NPSR1 3005/4885

“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.