Hydroxyamine

Hydroxyamine

SCHEMBL4563302

NO.O=C(O)c1ccc(-c2ccc(CNCCc3c[nH]c4ccccc34)cc2)s1

nearest known ligand 0.61

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 4/20 0.61
HTR6 P50406 2/20 0.61
KMT2A Q03164 4/20 0.60
HDAC3 O15379 3/20 0.54
HDAC4 P56524 3/20 0.54
HDAC7 Q8WUI4 3/20 0.54
HDAC2 Q92769 3/20 0.54
HDAC10 Q969S8 3/20 0.54
HDAC11 Q96DB2 3/20 0.54
HDAC8 Q9BY41 3/20 0.54
HDAC6 Q9UBN7 3/20 0.54
HDAC9 Q9UKV0 3/20 0.54
HDAC5 Q9UQL6 3/20 0.54
KCNH2 Q12809 1/20 0.54
MC5R P33032 2/20 0.51
MC3R P41968 2/20 0.51
MC1R Q01726 2/20 0.51
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
CDK4 P11802 1/20 0.47

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
Hydroxyamine SCHEMBL4563646 0.92 HTR6 (0.61) HDAC1HTR6KMT2AHDAC3HDAC4
SCHEMBL8289901 0.89 HDAC1 (0.76) HDAC1HTR6KMT2AHDAC3HDAC4
SCHEMBL4563301 0.89 HDAC1 (0.60) HDAC1HTR6KMT2AHDAC3HDAC4
Hydroxyamine SCHEMBL4563582 0.83 KMT2A (0.59) HDAC1HTR6KMT2AHDAC3HDAC4
Hydroxyamine SCHEMBL4563390 0.81 KMT2A (0.64) HDAC1HTR6KMT2AHDAC3HDAC4
SCHEMBL4553062 0.81 HTR6 (0.62) HDAC1HTR6KMT2AHDAC3HDAC4
SCHEMBL8288741 0.81 HDAC1 (0.70) HDAC1HTR6KMT2AHDAC3HDAC4
SCHEMBL4563645 0.81 HTR6 (0.56) HDAC1HTR6KMT2AHDAC3HDAC4
SCHEMBL8290074 0.80 ACKR3 (0.60) HDAC1KMT2ARAB9AMEN1
SCHEMBL23745517 0.79 MC5R (0.71) HDAC1HTR6KMT2AHDAC3HDAC4

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-1682538-A4 BIARYL LINKED HYDROXAMATES: PREPARATION AND PHARMACEUTICAL APPLICATIONS S BIO PTE LTD (SG) 2009-05-27 EP claimed
EP-1682538-A1 BIARYL LINKED HYDROXAMATES: PREPARATION AND PHARMACEUTICAL APPLICATIONS S*Bio Pte Ltd (SG) 2006-07-26 EP claimed
WO-2005040161-A1 BIARYL LINKED HYDROXAMATES: PREPARATION AND PHARMACEUTICAL APPLICATIONS S*BIO PTE LTD (SG) 2005-05-06 WO claimed