SCHEMBL7646346

SCHEMBL7646346

COC(=O)c1ccc(CC(=O)Nc2ccc(C(=O)Nc3ccc(C=Cc4ccc(OC)cc4)cc3C(=O)O)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.53
MAPT P10636 3/20 0.53
KDM4E B2RXH2 2/20 0.52
MEN1 O00255 7/20 0.51
KMT2A Q03164 7/20 0.51
RAB9A P51151 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
NPC1 O15118 1/20 0.50
LMNA P02545 1/20 0.50
PLK1 P53350 1/20 0.49
PLK3 Q9H4B4 1/20 0.49
MAPK1 P28482 2/20 0.49
SNCA P37840 2/20 0.48
CCR5 P51681 1/20 0.47
KCNK2 O95069 1/20 0.46
CYP2C9 P11712 1/20 0.46
HPGD P15428 1/20 0.46
CYP2C19 P33261 1/20 0.46
CACNA1B Q00975 1/20 0.46
APBA1 Q02410 1/20 0.46

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
SCHEMBL7650295 0.83 MEN1 (0.47) ALDH1A1MEN1KMT2ARAB9ANPC1
SCHEMBL7649936 0.82 NPC1 (0.63) ALDH1A1MAPTMEN1KMT2ARAB9A
SCHEMBL7648400 0.81 MAPT (0.54) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL7534111 0.80 MAPT (0.55) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL7534117 0.80 MAPT (0.55) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL7644901 0.79 RAB9A (0.58) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL7527359 0.76 MAPT (0.56) MAPTMEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL7527005 0.76 KDM4E (0.51) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL7528550 0.76 KDM4E (0.51) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL7527352 0.74 MAPT (0.57) ALDH1A1MAPTKDM4EMEN1KMT2A

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
US-6479548-B2 P-(BENZOYLAMINO)STILBENE DERIVATIVES TELIK, INC. 2002-11-12 US disclosed