SCHEMBL7787264

SCHEMBL7787264

Cc1cc(C)c(B(c2cccs2)c2c(C)cc(C)cc2C)c(C)c1.Cc1cc(C)c(B(c2cccs2)c2c(C)cc(C)cc2C)c(C)c1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 2/20 0.38
PTGS2 P35354 2/20 0.38
MAPT P10636 4/20 0.33
GAA P10253 4/20 0.33
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
TP53 P04637 2/20 0.33
LMNA P02545 2/20 0.33
RAPGEF4 Q8WZA2 3/20 0.32
KDM4E B2RXH2 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2A6 P11509 1/20 0.31
ALDH1A1 P00352 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
ALOX5 P09917 1/20 0.31
HPGD P15428 1/20 0.31

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
SCHEMBL127327 0.75 RAPGEF4 (0.37) TP53RAPGEF4SMN1; SMN2CYP1A2CYP2A6
SCHEMBL1477900 0.73 FBP1 (0.39) MAPTMEN1KMT2ALMNAKDM4E
SCHEMBL16722869 0.73 RAPGEF4 (0.38) RAPGEF4CYP1A2CYP2A6
SCHEMBL5960028 0.72 RAB9A (0.33) PTGS1PTGS2MAPTGAAMEN1
SCHEMBL1157695 0.71 RAPGEF4 (0.50) MAPTGAATP53LMNARAPGEF4
SCHEMBL418657 0.71 RAPGEF4 (0.33) RAPGEF4
SCHEMBL17146818 0.71 RAPGEF4 (0.33) RAPGEF4
SCHEMBL18462944 0.70 RAPGEF4 (0.45) RAPGEF4CYP1A2CYP2A6ALDH1A1
SCHEMBL26194225 0.70 RAPGEF4 (0.45) RAPGEF4CYP1A2CYP2A6ALDH1A1
SCHEMBL1309487 0.69 ESR2 (0.36) RAPGEF4

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
JP-2001072971-A ELECTROLUMINESCENT ELEMENT UNIV OSAKA 2001-03-21 JP disclosed