SCHEMBL362289

SCHEMBL362289

CC(Cc1ccc(C)cc1)=NO

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTBP2 P56545 1/20 0.55
HDAC3 O15379 1/20 0.44
HDAC4 P56524 1/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC7 Q8WUI4 1/20 0.44
HDAC2 Q92769 1/20 0.44
HDAC10 Q969S8 1/20 0.44
HDAC11 Q96DB2 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
HDAC9 Q9UKV0 1/20 0.44
HDAC5 Q9UQL6 1/20 0.44
IDO1 P14902 1/20 0.41
RAB9A P51151 3/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
NPC1 O15118 2/20 0.40
HPGD P15428 3/20 0.39
TDP1 Q9NUW8 1/20 0.39
CYP1A2 P05177 1/20 0.38
CYP2A6 P11509 1/20 0.38

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
SCHEMBL28007823 0.82 CTBP2 (0.52) CTBP2HDAC3HDAC4HDAC1HDAC7
SCHEMBL10889866 0.82 PLAU (0.42) CTBP2IDO1CYP2A6TAAR1ALDH1A1
SCHEMBL3656534 0.80 CTBP2 (0.53) CTBP2IDO1L3MBTL1TDP1KMT2A
SCHEMBL6070058 0.80 KDM4E (0.43) L3MBTL1NPC1HPGDTAAR1KMT2A
SCHEMBL6069238 0.80 KDM4E (0.43) L3MBTL1NPC1HPGDTAAR1KMT2A
SCHEMBL3658960 0.79 CTBP2 (0.52) CTBP2HDAC8HDAC6L3MBTL1KMT2A
SCHEMBL3671619 0.79 CTBP2 (0.57) CTBP2HDAC3HDAC4HDAC1HDAC7
SCHEMBL10177334 0.79 CTBP2 (0.52) CTBP2HDAC8HDAC6L3MBTL1KMT2A
SCHEMBL14667472 0.79 CTBP2 (0.52) CTBP2HDAC8HDAC6L3MBTL1KMT2A
SCHEMBL19392705 0.78 CTBP2 (0.43) CTBP2HDAC3HDAC4HDAC1HDAC7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2593426-A1 1-HYDROXYIMINO-3-PHENYL-PROPANES F.HOFFMANN-LA ROCHE AG (CH) 2013-05-22 EP disclosed
WO-2012007365-A1 1-HYDROXYIMINO-3-PHENYL-PROPANES F. HOFFMANN-LA ROCHE AG (CH) 2012-01-19 WO disclosed