SCHEMBL7721084

SCHEMBL7721084

O=C1C(=C2C=Cc3ccccc3C2=O)C=Cc2ccccc21

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.67
KMT2A Q03164 5/20 0.67
MAPT P10636 5/20 0.67
IDO1 P14902 4/20 0.67
KDM4E B2RXH2 3/20 0.67
LMNA P02545 3/20 0.67
POLB P06746 3/20 0.67
CES1 P23141 3/20 0.67
ALOX15 P16050 3/20 0.67
BCHE P06276 2/20 0.67
PTPRC P08575 2/20 0.67
THRB P10828 2/20 0.67
RECQL P46063 2/20 0.67
ALDH1A1 P00352 2/20 0.67
HPGD P15428 2/20 0.67
PKM P14618 1/20 0.67
PTPN1 P18031 1/20 0.67
ACHE P22303 1/20 0.67
HSD17B10 Q99714 1/20 0.67
PTPN22 Q9Y2R2 1/20 0.67

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
SCHEMBL7721082 1.00 MEN1 (0.67) MEN1KMT2AMAPTIDO1KDM4E
1,2-Naphthoquinone SCHEMBL29363665 0.80 PTPRC (1.00) MEN1KMT2AMAPTIDO1KDM4E
1,2-Naphthoquinone SCHEMBL15167712 0.80 PTPRC (1.00) MEN1KMT2AMAPTIDO1KDM4E
1,2-Naphthoquinone SCHEMBL173316 0.80 PTPRC (1.00) MEN1KMT2AMAPTIDO1KDM4E
SCHEMBL9617411 0.78 LMNA (0.50) MEN1KMT2AMAPTIDO1KDM4E
1,2-Naphthoquinone SCHEMBL30697786 0.78 PTPRC (0.95) MEN1KMT2AMAPTIDO1KDM4E
1,2-Naphthoquinone SCHEMBL30715501 0.78 PTPRC (0.95) MEN1KMT2AMAPTIDO1KDM4E
1,2-Naphthoquinone SCHEMBL27864137 0.78 PTPRC (0.95) MEN1KMT2AMAPTIDO1KDM4E
1,2-Naphthoquinone SCHEMBL28236061 0.78 PTPRC (0.95) MEN1KMT2AMAPTIDO1KDM4E
1,2-Naphthoquinone SCHEMBL28008660 0.78 PTPRC (0.95) MEN1KMT2AMAPTIDO1KDM4E

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-6406685-B1 COSMETICS FOR HAIR AND SKIN WITHOUT BLEEDING L'OREAL USA (FR) 2002-06-18 US disclosed
US-6333026-B1 MIXING-ALKOXY-(2,2'-BINAPHTHYLIDENE)-1,1'-DIONE DERIVATIVE WITH COSMETIC FORMULATION FOR LENGTHENING HOLD OF COSMETIC, DECREASING MIGRATION/TRANSFERRING, STREAKING L'OREAL (FR) 2001-12-25 US disclosed