SCHEMBL20146977

SCHEMBL20146977

Cc1ccc(-c2sc(-c3ccc(Cl)cc3)cc2Br)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SNCA P37840 1/20 0.46
PTGS2 P35354 1/20 0.45
MAPT P10636 3/20 0.42
ALDH1A1 P00352 2/20 0.42
POLB P06746 1/20 0.42
ESR1 P03372 2/20 0.41
ESR2 Q92731 2/20 0.41
IKBKB O14920 1/20 0.40
KDM4E B2RXH2 2/20 0.39
RAB9A P51151 2/20 0.39
NPC1 O15118 1/20 0.39
CASP3 P42574 1/20 0.39
SENP8 Q96LD8 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
NR1H4 Q96RI1 1/20 0.38
MEN1 O00255 1/20 0.37
GAA P10253 1/20 0.37
GFER P55789 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL14832796 0.91 SNCA (0.53) SNCAPTGS2MAPTALDH1A1POLB
SCHEMBL23448488 0.91 SNCA (0.53) SNCAMAPTALDH1A1ESR1ESR2
SCHEMBL14838327 0.85 SNCA (0.47) SNCAMAPTALDH1A1POLBIKBKB
SCHEMBL23447120 0.85 SNCA (0.47) SNCAMAPTALDH1A1POLBIKBKB
SCHEMBL14832844 0.83 SNCA (0.46) SNCAMAPTALDH1A1POLBESR1
SCHEMBL11525285 0.81 ESR1 (0.56) SNCAPTGS2MAPTALDH1A1POLB
SCHEMBL16021757 0.80 SNCA (0.46) SNCAESR1ESR2PTPN1
SCHEMBL14832510 0.74 IKBKB (0.42) SNCAMAPTALDH1A1POLBIKBKB
SCHEMBL28848007 0.74 ESR1 (0.43) SNCAMAPTALDH1A1ESR1ESR2
SCHEMBL20147055 0.74 ESR1 (0.43) SNCAMAPTALDH1A1ESR1ESR2

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-2760969-B1 DIARYLETHENE COMPOUNDS AND USES THEREOF SWITCH MAT INC (CA) 2018-05-16 EP disclosed