SCHEMBL27528693

SCHEMBL27528693

O=C(CO)N(Cc1ccccc1)C(=O)NO

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
ALDH1A1 P00352 2/20 0.45
NPSR1 Q6W5P4 1/20 0.45
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
HDAC8 Q9BY41 8/20 0.43
HDAC1 Q13547 7/20 0.43
HDAC6 Q9UBN7 7/20 0.43
HDAC3 O15379 5/20 0.43
HDAC2 Q92769 5/20 0.43
HDAC7 Q8WUI4 3/20 0.43
HDAC10 Q969S8 3/20 0.43
NCOR2 Q9Y618 2/20 0.43
HDAC4 P56524 2/20 0.43
HDAC11 Q96DB2 2/20 0.43
HDAC9 Q9UKV0 2/20 0.43
HDAC5 Q9UQL6 2/20 0.43
LMNA P02545 1/20 0.42
REN P00797 1/20 0.41

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
SCHEMBL28742879 0.85 NPC1 (0.46) NPC1RAB9AALDH1A1NPSR1KMT2A
SCHEMBL27807993 0.83 GAA (0.45) NPC1RAB9AALDH1A1NPSR1KMT2A
SCHEMBL27528690 0.79 NPC1 (0.46) NPC1RAB9AALDH1A1NPSR1KMT2A
SCHEMBL5146531 0.74 LMNA (0.55) NPC1RAB9AALDH1A1NPSR1KMT2A
SCHEMBL6647621 0.72 LMNA (0.57) NPC1RAB9AALDH1A1NPSR1KMT2A
SCHEMBL27337089 0.71 ALDH1A1 (0.44) NPC1RAB9AALDH1A1NPSR1KMT2A
SCHEMBL544272 0.71 NPC1 (0.75) NPC1RAB9AALDH1A1KMT2AMEN1
SCHEMBL31232614 0.69 NPC1 (0.56) NPC1RAB9AALDH1A1NPSR1KMT2A
SCHEMBL5144037 0.69 NPC1 (0.71) NPC1RAB9AALDH1A1KMT2AMEN1
SCHEMBL15373060 0.69 MEN1 (0.59) NPC1RAB9AALDH1A1NPSR1KMT2A

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
CN-1282502-C Preparation method and application of magnetic carrier immobilized Raney-Ni catalyst NANJING UNIVERSITY OF TECHNOLOGY (CN) 2006-11-01 CN disclosed
CN-1597106-A Preparation method and application of magnetic carrier immobilized Raney-Ni catalyst UNIV NANJING POLYTECHNICAL (CN) 2005-03-23 CN disclosed