SCHEMBL13323481

SCHEMBL13323481

CC(=O)C(Cc1cc2ccccc2[nH]1)N(C)C

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 1/20 0.51
MTNR1B P49286 1/20 0.51
ADAMTS4 O75173 1/20 0.45
LOXL2 Q9Y4K0 1/20 0.45
PYGL P06737 2/20 0.44
HTR2C P28335 1/20 0.42
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
FLT3 P36888 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
SCHEMBL12936626 0.79 MTNR1A (0.54) MTNR1AMTNR1BADAMTS4LOXL2KDM4E
SCHEMBL16656704 0.77 MTNR1A (0.55) MTNR1AMTNR1BADAMTS4LOXL2PYGL
Acetic Acid SCHEMBL5533726 0.75 MTNR1A (0.52) MTNR1AMTNR1BADAMTS4LOXL2KDM4E
SCHEMBL25885232 0.75 MTNR1A (0.52) MTNR1AMTNR1BADAMTS4LOXL2PYGL
SCHEMBL5159413 0.75 ADAMTS4 (0.54) MTNR1AMTNR1BADAMTS4LOXL2PYGL
SCHEMBL5365001 0.73 LOXL2 (0.55) MTNR1AMTNR1BADAMTS4LOXL2
SCHEMBL5249054 0.73 LOXL2 (0.55) MTNR1AMTNR1BADAMTS4LOXL2
SCHEMBL3120573 0.73 MTNR1A (0.60) MTNR1AMTNR1BLOXL2KDM4EALDH1A1
SCHEMBL30305027 0.73 LOXL2 (0.55) MTNR1AMTNR1BADAMTS4LOXL2
SCHEMBL9027554 0.73 LOXL2 (0.58) MTNR1AMTNR1BLOXL2

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
US-7709484-B1 Substituted melanocortin receptor-specific piperazine compounds PALATIN TECHNOLOGIES, INC. (US) 2010-05-04 US disclosed
US-7709484-B1 Substituted melanocortin receptor-specific piperazine compounds PALATIN TECHNOLOGIES, INC. (US) 2010-05-04 US disclosed