SCHEMBL7477216

SCHEMBL7477216

O=C(CCCBr)Nc1ccccc1Cc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.56
HDAC3 O15379 4/20 0.51
HDAC1 Q13547 4/20 0.51
HDAC2 Q92769 4/20 0.51
HDAC4 P56524 3/20 0.51
HDAC7 Q8WUI4 3/20 0.51
HDAC10 Q969S8 3/20 0.51
HDAC11 Q96DB2 3/20 0.51
HDAC8 Q9BY41 3/20 0.51
HDAC6 Q9UBN7 3/20 0.51
HDAC9 Q9UKV0 3/20 0.51
HDAC5 Q9UQL6 3/20 0.51
ALDH1A1 P00352 2/20 0.50
HPGD P15428 1/20 0.50
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
LMNA P02545 1/20 0.46
HTT P42858 1/20 0.46

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
SCHEMBL7468349 0.94 L3MBTL1 (0.54) L3MBTL1HDAC3HDAC1HDAC2HDAC4
SCHEMBL29025528 0.84 L3MBTL1 (0.62) L3MBTL1ALDH1A1HPGDKMT2ANPC1
SCHEMBL10690887 0.80 L3MBTL1 (0.64) L3MBTL1ALDH1A1HPGDKMT2ANPC1
SCHEMBL22966593 0.78 L3MBTL1 (0.62) L3MBTL1ALDH1A1HPGDMEN1KMT2A
SCHEMBL7931376 0.78 L3MBTL1 (0.62) L3MBTL1ALDH1A1HPGDMEN1KMT2A
SCHEMBL5804308 0.78 L3MBTL1 (0.67) L3MBTL1HDAC3HDAC1HDAC2HDAC4
SCHEMBL7562125 0.78 HDAC3 (0.71) L3MBTL1HDAC3HDAC1HDAC2HDAC4
SCHEMBL4172605 0.77 L3MBTL1 (0.70) L3MBTL1ALDH1A1HPGDMEN1KMT2A
SCHEMBL16342957 0.77 HDAC3 (0.55) HDAC3HDAC1HDAC2HDAC4HDAC7
SCHEMBL19421299 0.76 LTA4H (0.57) L3MBTL1ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0757986-B1 Arylpiperidine and arylpiperazine derivatives and drugs containing the same SUNTORY LTD (JP) 2002-06-12 EP disclosed
US-5723475-A Arylpiperidine and arylpiperazine derivatives and medicament containing the same SUNTORY LIMITED (JP) 1998-03-03 US disclosed
EP-0757986-A1 ARYLPIPERIDINE AND ARYLPIPERAZINE DERIVATIVES AND DRUGS CONTAINING THE SAME SUNTORY LIMITED (JP) 1997-02-12 EP disclosed