SCHEMBL7844527

SCHEMBL7844527

C=CCc1cc2c(c(CC=C)c1O)CCC(=O)N2

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.34
KDM4E B2RXH2 3/20 0.34
GLA P06280 1/20 0.34
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
POLB P06746 3/20 0.34
MAPT P10636 1/20 0.34
HPGD P15428 1/20 0.34
GABRA1 P14867 2/20 0.31
GABRB2 P47870 2/20 0.31
PTPN1 P18031 1/20 0.31
BRD4 O60885 1/20 0.31
ALDH1A1 P00352 1/20 0.30
SRD5A1 P18405 1/20 0.30

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
SCHEMBL7854062 0.78 KDM4E (0.36) GAAKDM4EGLAMEN1KMT2A
SCHEMBL7854440 0.78 GAA (0.34) GAAKDM4EGLAMEN1KMT2A
SCHEMBL7854016 0.77 SRD5A1 (0.41) GAAKDM4EMEN1KMT2APOLB
SCHEMBL7853444 0.74 CYP19A1 (0.42) POLBHPGDGABRA1GABRB2PTPN1
SCHEMBL7851986 0.74 PTPN1 (0.43) PTPN1
SCHEMBL12559791 0.73 BRD4 (0.37) GAAKDM4EGLAMEN1KMT2A
SCHEMBL7855978 0.71 CYP19A1 (0.45) POLBHPGDGABRA1GABRB2PTPN1
SCHEMBL429180 0.71 BRD4 (0.43) BRD4ALDH1A1
SCHEMBL8660070 0.71 KDM4E (0.34) GAAKDM4EGLAMEN1KMT2A
SCHEMBL426989 0.71 NPC1 (0.42) KDM4EGABRA1GABRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1084330-C Cydic amide derivatives OTSUKA PHARMA CO LTD (JP) 2002-05-08 CN disclosed
EP-0719258-B1 CYCLIC AMIDE DERIVATIVES FOR PROTECTING AGAINST ULTRAVIOLET RAYS OTSUKA PHARMA CO LTD (JP) 2001-10-31 EP disclosed
US-5786367-A OXYGEN SCAVENGERS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1998-07-28 US disclosed
CN-1130377-A Cyclic amide derivatives OTSUKA PHARMA CO LTD (JP) 1996-09-04 CN disclosed