SCHEMBL8600665

SCHEMBL8600665

CC(=CCc1cccc2ccccc12)C(N)=O

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 2/20 0.48
TDP1 Q9NUW8 1/20 0.47
HPGD P15428 1/20 0.46
HTT P42858 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
PARP10 Q53GL7 1/20 0.43
ACP3 P15309 1/20 0.42
CYP1A2 P05177 2/20 0.42
SIRT5 Q9NXA8 1/20 0.42
ATM Q13315 1/20 0.41
LMNA P02545 1/20 0.41
PKM P14618 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C19 P33261 1/20 0.41
CTNNB1 P35222 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
SCHEMBL17595169 0.86 TDP1 (0.53) MTNR1ATDP1MEN1KMT2AACP3
SCHEMBL29466950 0.85 NOS3 (0.36) MTNR1ATDP1HPGDHTTL3MBTL1
SCHEMBL59798 0.85 NOS3 (0.36) MTNR1ATDP1HPGDHTTL3MBTL1
SCHEMBL28573448 0.82 MTNR1A (0.46) MTNR1ATDP1HPGDHTTL3MBTL1
SCHEMBL4079712 0.82 CYP1A2 (0.40) MTNR1AHPGDHTTMEN1KMT2A
SCHEMBL4080178 0.81 KMT2A (0.48) MTNR1ATDP1HPGDHTTL3MBTL1
SCHEMBL3682565 0.80 XPO1 (0.51) MTNR1ATDP1HPGDHTTACP3
SCHEMBL3871452 0.79 AKR1B1 (0.44) HPGDHTTMEN1KMT2ACYP1A2
SCHEMBL18317860 0.79 TDP1 (0.42) MTNR1ATDP1L3MBTL1MEN1KMT2A
SCHEMBL4078029 0.78 HTR2A (0.44) HPGDL3MBTL1MEN1KMT2ACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0667957-B1 SEPARATION MEDIA FOR ELECTROPHORESIS SOANE TECHNOLOGIES INC (US) 1998-01-28 EP disclosed
US-5569364-A CONTAINING GEL PARTICLES WHICH CAN BE SWOLLEN AND COLLAPSED BY SMALL CHANGES IN TEMPERATURE, PH, AND IONIC STRENGTH OF SOLVENT, THUS CHANGING VISCOSITY SOANE BIOSCIENCES, INC. (US) 1996-10-29 US disclosed
WO-1995030782-A1 SEPARATION MEDIA FOR USE IN GEL ELECTROPHORESIS SOANE BIOSCIENCES (US) 1995-11-16 WO disclosed
EP-0667957-A1 SEPARATION MEDIA FOR ELECTROPHORESIS SOANE TECHNOLOGIES INC. (US) 1995-08-23 EP disclosed
WO-1994010561-A1 SEPARATION MEDIA FOR ELECTROPHORESIS SOANE TECHNOLOGIES, INC. (US) 1994-05-11 WO disclosed