SCHEMBL8673185

SCHEMBL8673185

O=CN(Cc1ccccc1)C(=O)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.51
KMT2A Q03164 3/20 0.50
MEN1 O00255 2/20 0.50
HDAC1 Q13547 2/20 0.50
HDAC6 Q9UBN7 2/20 0.50
HDAC3 O15379 1/20 0.50
HDAC7 Q8WUI4 1/20 0.50
HDAC10 Q969S8 1/20 0.50
HDAC8 Q9BY41 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
TSHR P16473 2/20 0.49
L3MBTL1 Q9Y468 1/20 0.47
CRHBP P24387 1/20 0.46
CRHR2 Q13324 1/20 0.46
KDM4E B2RXH2 1/20 0.46
LMNA P02545 1/20 0.46
ALDH1A1 P00352 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
CTSL P07711 1/20 0.44
CTSS P25774 1/20 0.44

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
SCHEMBL9651473 0.90 TAS2R14 (0.48) HSD11B1KMT2AMEN1HDAC1HDAC6
SCHEMBL14855018 0.88 KMT2A (0.49) KMT2AMEN1TDP1TSHRKDM4E
SCHEMBL6551303 0.85 HSD11B1 (0.51) HSD11B1KMT2AMEN1HDAC1HDAC6
SCHEMBL14855305 0.84 GAA (0.66) KMT2AMEN1TDP1TSHRKDM4E
SCHEMBL7405546 0.84 NPC1 (0.48) KMT2AMEN1TDP1TSHRL3MBTL1
Hydrochloric Acid SCHEMBL11685888 0.82 NPC1 (0.47) KMT2AMEN1TDP1TSHRL3MBTL1
SCHEMBL14493279 0.81 ALDH1A1 (0.42) HSD11B1KMT2AMEN1TDP1TSHR
SCHEMBL10296224 0.81 GSK3B (0.45) HSD11B1KMT2AMEN1TDP1TSHR
SCHEMBL12650288 0.81 ALDH1A1 (0.53) KMT2AMEN1HDAC1HDAC6TDP1
SCHEMBL1003508 0.79 HDAC1 (0.71) HSD11B1KMT2AMEN1HDAC1HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5128488-A Phosphorus-metal complex catalyst SOCIETE CHIMIQUE DES CHARBONNAGES S.A. (FR) 1992-07-07 US claimed
EP-0253700-B1 PROCESS FOR THE ASYMMETRIC HYDROGENATION OF CARBONYL COMPOUNDS, AND THE COMPOUNDS OBTAINED THEREBY ELF ATOCHEM S.A. (FR) 1990-08-29 EP claimed
EP-0253700-A1 Process for the asymmetric hydrogenation of carbonyl compounds, and the compounds obtained thereby ELF ATOCHEM S.A. (FR) 1988-01-20 EP claimed
WO-1987007889-A1 ASYMETRIC HYDROGENATION PROCESS FOR CARBONYL COMPOUNDS, AND COMPOUNDS OBTAINED SOCIETE CHIMIQUE DES CHARBONNAGES S.A. (FR) 1987-12-30 WO claimed
US-5834588-A (Cyanomethylene) phosphoranes as carbonyl 1,1-dipole synthons for use in constructing combinatorial libraries YALE UNIVERSITY (US) 1998-11-10 US disclosed
EP-0443923-B1 New aminophosphine-phosphinites, their process and their use for enantio-selective reactions SANOFI SA (FR) 1997-08-27 EP disclosed
US-5128488-A Phosphorus-metal complex catalyst SOCIETE CHIMIQUE DES CHARBONNAGES S.A. (FR) 1992-07-07 US disclosed
EP-0443923-A1 New aminophosphine-phosphinites, their process and their use for enantio-selective reactions SANOFI (FR) 1991-08-28 EP disclosed
EP-0253700-B1 PROCESS FOR THE ASYMMETRIC HYDROGENATION OF CARBONYL COMPOUNDS, AND THE COMPOUNDS OBTAINED THEREBY ELF ATOCHEM S.A. (FR) 1990-08-29 EP disclosed
EP-0253700-A1 Process for the asymmetric hydrogenation of carbonyl compounds, and the compounds obtained thereby ELF ATOCHEM S.A. (FR) 1988-01-20 EP disclosed
WO-1987007889-A1 ASYMETRIC HYDROGENATION PROCESS FOR CARBONYL COMPOUNDS, AND COMPOUNDS OBTAINED SOCIETE CHIMIQUE DES CHARBONNAGES S.A. (FR) 1987-12-30 WO disclosed