SCHEMBL4540403

SCHEMBL4540403

CC(NCc1ccc(Cl)c(NC(=O)c2ccccc2)c1)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 3/20 0.53
HDAC8 Q9BY41 2/20 0.51
HDAC6 Q9UBN7 2/20 0.51
SMN1; SMN2 Q16637 4/20 0.47
MAPT P10636 3/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
RAB9A P51151 2/20 0.46
NPC1 O15118 1/20 0.46
SSTR3 P32745 1/20 0.46
CYP1A2 P05177 1/20 0.46
KDM4E B2RXH2 2/20 0.45
ALDH1A1 P00352 1/20 0.45
MAPK1 P28482 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
HPGD P15428 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
SCHEMBL4990054 1.00 HDAC1 (0.53) HDAC1HDAC8HDAC6SMN1; SMN2MAPT
SCHEMBL4540069 0.92 HDAC1 (0.61) HDAC1HDAC8HDAC6SMN1; SMN2MEN1
SCHEMBL4999656 0.92 HDAC1 (0.61) HDAC1HDAC8HDAC6SMN1; SMN2MEN1
SCHEMBL4542218 0.90 TSHR (0.55) HDAC1SMN1; SMN2RAB9ANPC1KDM4E
SCHEMBL4999726 0.90 TSHR (0.55) HDAC1SMN1; SMN2RAB9ANPC1KDM4E
SCHEMBL4999756 0.89 SMN1; SMN2 (0.52) HDAC1SMN1; SMN2MEN1KMT2ACYP1A2
SCHEMBL4999705 0.88 HDAC1 (0.45) HDAC1HDAC8HDAC6SMN1; SMN2MAPT
SCHEMBL4996347 0.88 SMN1; SMN2 (0.48) HDAC1SMN1; SMN2MEN1KMT2ARAB9A
SCHEMBL3960528 0.87 MDM4 (0.50) HDAC1HDAC8HDAC6SMN1; SMN2MAPT
SCHEMBL4999677 0.87 MDM4 (0.50) HDAC1HDAC8HDAC6SMN1; SMN2MAPT

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-2079525-A1 CALCIUM RECEPTOR MODULATING AGENTS Amgen Inc. (US) 2009-07-22 EP claimed
WO-2008057282-A1 CALCIUM RECEPTOR MODULATING AGENTS AMGEN INC. (US) 2008-05-15 WO claimed