SCHEMBL13183116

SCHEMBL13183116

CN(C)C(=O)c1ccccc1C(=O)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 3/20 0.61
KMT2A Q03164 3/20 0.56
MEN1 O00255 2/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
TSHR P16473 1/20 0.52
GAA P10253 1/20 0.52
MAPT P10636 1/20 0.52
ALDH1A1 P00352 3/20 0.50
HPGD P15428 2/20 0.50
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
CDC25B P30305 1/20 0.48
ATM Q13315 1/20 0.48
POLB P06746 1/20 0.47
NR4A1 P22736 1/20 0.47
KEAP1 Q14145 1/20 0.46
MYC P01106 1/20 0.45

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
SCHEMBL3305342 0.86 AKR1C3 (0.59) AKR1C3KMT2ATSHRGAAMAPT
SCHEMBL188296 0.85 MEN1 (0.65) KMT2AMEN1SMN1; SMN2TSHRGAA
SCHEMBL29447165 0.82 AKR1C3 (0.85) AKR1C3KMT2AMEN1TSHRGAA
SCHEMBL700595 0.82 AKR1C3 (0.85) AKR1C3KMT2AMEN1TSHRGAA
SCHEMBL3309083 0.82 AKR1C3 (0.53) AKR1C3SMN1; SMN2TSHRGAAMAPT
SCHEMBL1018643 0.81 ALDH1A1 (0.64) AKR1C3KMT2AMEN1SMN1; SMN2MAPT
SCHEMBL18919366 0.81 AKR1C3 (0.57) AKR1C3KMT2ATSHRGAAMAPT
SCHEMBL28883310 0.80 AKR1C3 (0.81) AKR1C3KMT2AMEN1SMN1; SMN2GAA
Fluoride SCHEMBL28319246 0.80 AKR1C3 (0.81) AKR1C3KMT2AMEN1SMN1; SMN2GAA
SCHEMBL13159280 0.79 HPGD (0.69) AKR1C3KMT2AMEN1SMN1; SMN2TSHR

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
US-20100222454-A1 DEGRADATION ACCELERATOR FOR POLYMERS AND POLYMER ARTICLE COMPRISING IT CIBA CORPORATION (US) 2010-09-02 US disclosed