SCHEMBL7792475

SCHEMBL7792475

Cc1c(C)c(OCc2ccccc2)c(C(=O)C=Cc2ccc(OCc3ccccc3)cc2OCc2ccccc2)c2c1OC(C)(C)CC2

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 2/20 0.44
NFKB1 P19838 3/20 0.41
NFKB2 Q00653 3/20 0.41
RELA Q04206 3/20 0.41
SLC5A1 P13866 1/20 0.40
SLC5A2 P31639 1/20 0.40
APP P05067 1/20 0.39
MAPT P10636 1/20 0.39
PTPN1 P18031 3/20 0.38
PTGER3 P43115 2/20 0.38
PTGER1 P34995 1/20 0.38
PTGER4 P35408 1/20 0.38
PTGER2 P43116 1/20 0.38
PTPN2 P17706 1/20 0.38
MEN1 O00255 1/20 0.37
POLB P06746 1/20 0.37
PKM P14618 1/20 0.37
BLM P54132 1/20 0.37
KMT2A Q03164 1/20 0.37
TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL7792471 0.85 APP (0.41) HDAC8NFKB1NFKB2RELASLC5A1
SCHEMBL7796628 0.81 HDAC8 (0.56) HDAC8SLC5A1SLC5A2APPMAPT
SCHEMBL7796507 0.81 NFKB1 (0.39) NFKB1NFKB2RELAPTGER3PTGER1
SCHEMBL7786615 0.79 HDAC8 (0.59) HDAC8SLC5A1SLC5A2APPMAPT
SCHEMBL7796530 0.79 PSEN1 (0.41) MAPTPTPN1TDP1
SCHEMBL7792878 0.78 HDAC8 (0.53) HDAC8SLC5A1SLC5A2APPMAPT
SCHEMBL7792951 0.77 HDAC8 (0.59) HDAC8SLC5A1SLC5A2APPMAPT
SCHEMBL7796504 0.77 MAOB (0.37) MAPT
SCHEMBL8308667 0.74 PSEN1 (0.45) MAPTPTPN1POLBTDP1
SCHEMBL20169835 0.71 SLC5A1 (0.53) HDAC8SLC5A1SLC5A2APPMAPT

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
EP-0909267-B1 NOVEL 1,3-DIPHENYLPROPANE DERIVATIVES HAVING INHIBITORY ACTIVITY AGAINST TYROSINASE AND PROCESS FOR PREPARATION THEREOF LG CHEMICAL LTD (KR) 2001-11-21 EP disclosed
US-6093836-A INHIBITORY ACTIVITY AGAINT MELANIN BIOSYNTHESIS; WHITENING SUBSTANCES FOR MEDICAMENTS, COSMETICS LG CHEMICAL LTD. (KR) 2000-07-25 US disclosed