SCHEMBL15225637

SCHEMBL15225637

COCCc1cc(OCOC)ccc1C(=O)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.48
MAPK1 P28482 4/20 0.48
HPGD P15428 2/20 0.48
ALDH1A1 P00352 2/20 0.48
HTT P42858 2/20 0.48
CYP1A2 P05177 1/20 0.48
PGR P06401 1/20 0.48
CYP2D6 P10635 1/20 0.48
SLC6A2 P23975 1/20 0.48
PDE4A P27815 1/20 0.48
CYP2C19 P33261 1/20 0.48
HRH1 P35367 1/20 0.48
SLC6A3 Q01959 1/20 0.48
PDE4D Q08499 1/20 0.48
MAPT P10636 5/20 0.47
POLB P06746 1/20 0.45
L3MBTL1 Q9Y468 4/20 0.44
KDM4E B2RXH2 2/20 0.42
GAA P10253 1/20 0.41
SMN1; SMN2 Q16637 3/20 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
SCHEMBL2855838 0.81 MAPT (0.41) LMNAMAPK1HPGDHTTCYP1A2
SCHEMBL23409171 0.80 MAPT (0.51) LMNAMAPK1HPGDALDH1A1HTT
SCHEMBL30070834 0.80 MAPT (0.51) LMNAMAPK1HPGDALDH1A1HTT
SCHEMBL15684529 0.77 KMT2A (0.56) LMNAMAPK1HPGDALDH1A1HTT
SCHEMBL7661858 0.77 GAA (0.62) LMNAMAPK1ALDH1A1HTTMAPT
SCHEMBL10476884 0.76 LMNA (0.69) LMNAMAPK1HPGDALDH1A1HTT
SCHEMBL28622015 0.75 LTB4R (0.47) LMNAMAPK1HPGDALDH1A1CYP1A2
SCHEMBL30785064 0.75 PTPN11 (0.52) MAPK1MAPTPOLBKDM4E
SCHEMBL10293784 0.75 LMNA (0.68) LMNAMAPK1HPGDALDH1A1HTT
SCHEMBL28081760 0.74 ALDH1A1 (0.47) LMNAMAPK1HPGDALDH1A1HTT

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
EP-1642880-B1 HSP90 FAMILY PROTEIN INHIBITORS KYOWA HAKKO KIRIN CO LTD (JP) 2013-09-04 EP disclosed