SCHEMBL16628828

SCHEMBL16628828

O=C1C=C(Br)/C(=C\c2ccccc2)O1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.50
KDM4E B2RXH2 4/20 0.50
HPGD P15428 4/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
STK17B O94768 1/20 0.46
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
MAPT P10636 2/20 0.41
MITF O75030 1/20 0.41
LMNA P02545 1/20 0.41
NTSR1 P30989 1/20 0.41
HTT P42858 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
PNLIP P16233 1/20 0.39
ACHE P22303 1/20 0.39
CYP1A2 P05177 2/20 0.38
POLB P06746 1/20 0.38

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
SCHEMBL2166669 1.00 ALDH1A1 (0.50) ALDH1A1KDM4EHPGDL3MBTL1TDP1
SCHEMBL16628829 1.00 ALDH1A1 (0.50) ALDH1A1KDM4EHPGDL3MBTL1TDP1
SCHEMBL2164768 0.80 KDM4E (0.49) ALDH1A1KDM4EHPGDL3MBTL1TDP1
SCHEMBL2164772 0.80 KDM4E (0.49) ALDH1A1KDM4EHPGDL3MBTL1TDP1
SCHEMBL2164776 0.80 KDM4E (0.49) ALDH1A1KDM4EHPGDL3MBTL1TDP1
SCHEMBL2167216 0.76 MAPT (0.41) ALDH1A1KDM4ETDP1MEN1KMT2A
SCHEMBL2314384 0.76 MAPT (0.41) ALDH1A1KDM4ETDP1MEN1KMT2A
SCHEMBL2314381 0.76 MAPT (0.41) ALDH1A1KDM4ETDP1MEN1KMT2A
SCHEMBL9564397 0.75 ALDH1A1 (0.72) ALDH1A1KDM4EHPGDL3MBTL1TDP1
SCHEMBL6137729 0.74 ALDH1A1 (0.42) ALDH1A1KDM4EHPGDL3MBTL1TDP1

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
EP-2350036-B1 METHYLENE FURANONE DERIVATIVES AND USE OF SAID DERIVATIVES AS A PHOTOPROTECTING OR ANTIOXIDANT OR DEPIGMENTATION AGENT IN COSMETIC OR DERMATOLOGICAL COMPOSITIONS PIERRE FABRE DERMO COSMÉTIQUE (FR) 2015-04-15 EP disclosed