SCHEMBL3934587

SCHEMBL3934587

CCN(CC)c1ccc(C(=O)c2c(C(=O)O)cccc2-c2cccc(C(=O)c3ccccc3)c2)c(O)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.61
KMT2A Q03164 4/20 0.61
SMN1; SMN2 Q16637 2/20 0.61
L3MBTL1 Q9Y468 2/20 0.61
ALDH1A1 P00352 4/20 0.49
GAA P10253 2/20 0.49
KDM4E B2RXH2 2/20 0.49
POLB P06746 1/20 0.49
HSD17B14 Q9BPX1 1/20 0.42
CNR2 P34972 1/20 0.41
MAOB P27338 1/20 0.41
UCHL5 Q9Y5K5 1/20 0.39
LMNA P02545 2/20 0.38
MAPT P10636 2/20 0.38
USP2 O75604 1/20 0.37
KEAP1 Q14145 1/20 0.37
NFE2L2 Q16236 1/20 0.37
MCL1 Q07820 3/20 0.37
BCL2L1 Q07817 2/20 0.37
HPGD P15428 2/20 0.36

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
SCHEMBL11369420 0.83 MEN1 (0.78) MEN1KMT2ASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL4654342 0.80 MEN1 (0.65) MEN1KMT2ASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL2780893 0.80 MEN1 (0.74) MEN1KMT2ASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL29437222 0.80 MEN1 (0.74) MEN1KMT2ASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL18315858 0.79 SMN1; SMN2 (0.70) MEN1KMT2ASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL27826035 0.78 MEN1 (0.67) MEN1KMT2ASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL39206 0.77 KMT2A (1.00) MEN1KMT2ASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL3366145 0.74 SMN1; SMN2 (0.63) MEN1KMT2ASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL27913467 0.74 MEN1 (0.89) MEN1KMT2ASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL9620455 0.73 HPGD (0.50) MEN1KMT2AL3MBTL1ALDH1A1CNR2

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
WO-2009010688-A2 SKIN-COLOURING COMPOSITION CONTAINING A SELF-TANNING AGENT AND A COLORANT OBTAINED BY REACTING AN AMINE WITH DEHYDROASCORBIC ACID OR ONE OF THE MONOMER, POLYMER OR ISOMER DERIVATIVES THEREOF L'OREAL (FR) 2009-01-22 WO disclosed
EP-1885730-A1 SILANE MEROCYANINE SULPHONE DERIVATIVES; PHOTOPROTECTING COMPOSITIONS CONTAINING SAME; USE THEREOF AS UV FILTER L'OREAL (FR) 2008-02-13 EP disclosed
WO-2007077333-A2 USE OF A NEUROPEPTIDE Y ANTAGONIST FOR DAMAGED OR SENSITIVE LIPS L'OREAL (FR) 2007-07-12 WO disclosed
WO-2006032741-A1 SILANE MEROCYANINE SULPHONE DERIVATIVES; PHOTOPROTECTING COMPOSITIONS CONTAINING SAME; USE THEREOF AS UV FILTER L'ORÉAL (FR) 2006-03-30 WO disclosed