SCHEMBL14979286

SCHEMBL14979286

COC(=O)c1cc(CNC(=O)[C@]23COC[C@H]2C3)ccc1Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.44
LMNA P02545 3/20 0.44
TSHR P16473 5/20 0.41
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 2/20 0.38
GAA P10253 1/20 0.38
TP53 P04637 1/20 0.38
MAPT P10636 1/20 0.38
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
HSD17B10 Q99714 1/20 0.38
ADORA3 P0DMS8 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
CYP4F2 P78329 1/20 0.36
CYP4A11 Q02928 1/20 0.36
THRB P10828 1/20 0.35
APEX1 P27695 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
SCHEMBL14783152 0.76 LMNA (0.55) HPGDLMNATSHRMEN1KMT2A
SCHEMBL14782820 0.74 LMNA (0.48) HPGDLMNATSHRKMT2AALDH1A1
SCHEMBL14782977 0.73 HPGD (0.55) HPGDLMNATSHRKDM4EALDH1A1
SCHEMBL14782827 0.71 ERCC1 (0.53) HPGDLMNATSHRMEN1KMT2A
SCHEMBL9932144 0.70 PTGES (0.57) HPGDLMNATSHRSMN1; SMN2CYP4F2
SCHEMBL14782792 0.70 PTGES (0.57) HPGDLMNATSHRHTTSMN1; SMN2
SCHEMBL14782775 0.70 PKM (0.55) HPGDLMNATSHRKMT2AKDM4E
SCHEMBL12332820 0.69 CYP4F2 (0.58) HPGDLMNATSHRMEN1KMT2A
SCHEMBL14969490 0.69 TSHR (0.57) HPGDLMNATSHRALDH1A1GAA
SCHEMBL14783086 0.69 HPGD (0.52) HPGDLMNATSHRMEN1KMT2A

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
WO-2013072825-A1 PHTALAZINONE DERIVATIVES AS MPEGS -1 INHIBITORS GLENMARK PHARMACEUTICALS S.A. (CH) 2013-05-23 WO disclosed