SCHEMBL704812

SCHEMBL704812

Cc1cc(O)ccc1N=NC=c1[nH]c(=O)c(=Cc2cnc(NCC(F)(F)F)s2)s1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
THRB P10828 1/20 0.33
RECQL P46063 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL704811 1.00 MEN1 (0.33) MEN1ALDH1A1LMNAPOLBGAA
SCHEMBL709596 0.82 MEN1 (0.31) MEN1ALDH1A1LMNAPOLBGAA
SCHEMBL709595 0.82 MEN1 (0.31) MEN1ALDH1A1LMNAPOLBGAA
SCHEMBL704130 0.76 LMNA (0.34) MEN1LMNAPOLBMAPTKMT2A
SCHEMBL704131 0.76 LMNA (0.34) MEN1LMNAPOLBMAPTKMT2A
SCHEMBL703955 0.75 PIK3CA (0.32)
SCHEMBL702580 0.75 OGA (0.39) MEN1ALDH1A1LMNAGAAMAPT
SCHEMBL702579 0.75 OGA (0.39) MEN1ALDH1A1LMNAGAAMAPT
SCHEMBL650831 0.74 MAPT (0.43) MEN1LMNAPOLBMAPTRECQL
SCHEMBL650832 0.74 MAPT (0.43) MEN1LMNAPOLBMAPTRECQL

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-2423204-A1 THIAZOLIDINONE DERIVATIVE SBI Biotech Co., Ltd. (JP) 2012-02-29 EP disclosed