SCHEMBL9630613

SCHEMBL9630613

CC(=O)Oc1c(C)c(C)c2c(c1C)CCC(C)(COc1ccc([N+](=O)[O-])cn1)O2

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TTPA P49638 3/20 0.48
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
PDE4A P27815 1/20 0.47
PDE3A Q14432 1/20 0.47
ALOX5 P09917 1/20 0.40
GABRA5 P31644 1/20 0.37
PTPN1 P18031 1/20 0.37
GSTO1 P78417 1/20 0.37
MAPT P10636 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
PSEN1 P49768 5/20 0.36
PPARG P37231 1/20 0.36

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
SCHEMBL7536176 0.87 TTPA (0.51) TTPAMEN1KMT2APDE4APDE3A
SCHEMBL9631272 0.87 MAPT (0.48) TTPAMEN1KMT2AALOX5MAPT
SCHEMBL9631363 0.86 GABRA5 (0.38) TTPAMEN1KMT2APDE4APDE3A
SCHEMBL9633187 0.86 MEN1 (0.49) TTPAMEN1KMT2APDE4APDE3A
SCHEMBL8059389 0.81 TTPA (0.49) TTPAMEN1KMT2APDE4APDE3A
SCHEMBL10641788 0.80 MEN1 (0.53) TTPAMEN1KMT2APDE4APDE3A
SCHEMBL9631978 0.79 MEN1 (0.45) TTPAMEN1KMT2APDE4APDE3A
SCHEMBL7496926 0.76 MEN1 (0.52) TTPAMEN1KMT2APDE4APDE3A
SCHEMBL7487350 0.76 MEN1 (0.52) TTPAMEN1KMT2APDE4APDE3A
SCHEMBL6978127 0.76 TTPA (0.47) TTPAMEN1KMT2APDE4APDE3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5104888-A Anticholesterol or antidiabetic agents SANKYO COMPANY, LIMITED (JP) 1992-04-14 US disclosed
EP-0207581-B1 THIAZOLIDINE DERIVATIVES, THEIR PREPARATION AND USE SANKYO COMPANY LIMITED (JP) 1990-09-12 EP disclosed
EP-0207581-A2 Thiazolidine derivatives, their preparation and use SANKYO COMPANY LIMITED (JP) 1987-01-07 EP disclosed