SCHEMBL3353157

SCHEMBL3353157

Cc1c(CN2CCOCC2)c2cc([N+](=O)[O-])ccc2n1C

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.55
CTSB P07858 1/20 0.52
ALDH1A1 P00352 6/20 0.51
LMNA P02545 3/20 0.51
KCNJ1 P48048 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
PKM P14618 3/20 0.46
POLB P06746 2/20 0.45
CNR1 P21554 2/20 0.43
CNR2 P34972 2/20 0.43

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
SCHEMBL3357288 0.79 CNR2 (0.46) MAPTALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL13537329 0.79 CNR2 (0.44) MAPTALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL3358883 0.78 CTSB (0.59) MAPTCTSBALDH1A1LMNAKCNJ1
SCHEMBL9400567 0.77 MAPT (0.67) MAPTLMNASMN1; SMN2MEN1KMT2A
SCHEMBL28753894 0.75 MAPT (0.63) MAPTALDH1A1LMNASMN1; SMN2MEN1
SCHEMBL3357604 0.75 CTSB (0.56) MAPTCTSBALDH1A1LMNAKCNJ1
SCHEMBL17979926 0.74 CTSB (0.71) MAPTCTSBALDH1A1LMNAKCNJ1
SCHEMBL2573641 0.74 CTSB (0.67) MAPTCTSBALDH1A1LMNAKCNJ1
SCHEMBL9400698 0.73 MAPT (0.60) MAPTLMNASMN1; SMN2MEN1KMT2A
SCHEMBL3357652 0.73 CTSB (0.59) MAPTCTSBALDH1A1LMNAKCNJ1

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-2141163-A1 Substituted thiazolidinones, their production and utilisation as medicine Bayer Schering Pharma AG (DE) 2010-01-06 EP disclosed