SCHEMBL8699095

SCHEMBL8699095

CN(C(=O)CCc1ccccc1)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MLYCD O95822 2/20 0.64
KMT2A Q03164 4/20 0.57
FFAR1 O14842 1/20 0.54
ALOX5 P09917 2/20 0.51
KDM4E B2RXH2 1/20 0.50
MEN1 O00255 3/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
HTT P42858 1/20 0.49
MMP12 P39900 1/20 0.49
ALDH1A1 P00352 1/20 0.49
KEAP1 Q14145 1/20 0.47
GAA P10253 1/20 0.47
HPGD P15428 1/20 0.47
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
NPY5R Q15761 1/20 0.44
LMNA P02545 1/20 0.44
POLB P06746 1/20 0.44
PKM P14618 1/20 0.44
NPSR1 Q6W5P4 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
SCHEMBL8696461 0.91 ALOX5 (0.56) MLYCDKMT2AFFAR1ALOX5ALDH1A1
SCHEMBL4064688 0.90 MLYCD (0.67) MLYCDKMT2AFFAR1ALOX5KDM4E
SCHEMBL8695755 0.89 ALOX5 (0.63) MLYCDKMT2AFFAR1ALOX5ALDH1A1
SCHEMBL22445695 0.83 MLYCD (0.46) MLYCDKMT2AKDM4EL3MBTL1ALDH1A1
SCHEMBL18180430 0.83 NPC1 (0.61) MLYCDKMT2AALOX5L3MBTL1ALDH1A1
SCHEMBL7335518 0.83 MLYCD (0.71) MLYCDKMT2AALOX5MEN1L3MBTL1
SCHEMBL2202823 0.83 KDM4E (0.62) MLYCDKMT2AALOX5KDM4EMEN1
SCHEMBL7088866 0.81 FFAR1 (0.65) KMT2AFFAR1MEN1L3MBTL1HTT
SCHEMBL2833357 0.81 MLYCD (0.61) MLYCDKMT2AALOX5KDM4EMEN1
SCHEMBL2831110 0.81 MLYCD (0.57) MLYCDKMT2AKDM4EALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5726319-A Biphenyl substituted dipeptide analogs promote release of growth hormone MERCK & CO., INC. (US) 1998-03-10 US disclosed