SCHEMBL9718477

SCHEMBL9718477

C=Cc1ccc(N2c3ccccc3Sc3ccccc32)cc1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 2/20 0.50
MAOA P21397 1/20 0.42
ALDH1A1 P00352 3/20 0.40
TSHR P16473 1/20 0.40
MAPT P10636 1/20 0.39
PKM P14618 1/20 0.39
BCHE P06276 6/20 0.39
KMT2A Q03164 1/20 0.39
PTGS1 P23219 2/20 0.38
PTGS2 P35354 2/20 0.38
ACHE P22303 2/20 0.37
NOX1 Q9Y5S8 1/20 0.37
KDM1A O60341 1/20 0.34

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
SCHEMBL29851224 0.84 HDAC6 (0.62) HDAC6MAOABCHEKMT2APTGS1
SCHEMBL12190901 0.84 HDAC6 (0.62) HDAC6MAOABCHEKMT2APTGS1
SCHEMBL7210449 0.82 HDAC6 (0.54) HDAC6MAOAALDH1A1BCHEACHE
SCHEMBL15470447 0.79 HDAC6 (0.57) HDAC6MAOABCHEKMT2APTGS1
SCHEMBL342426 0.78 HDAC6 (0.56) HDAC6MAOABCHEKMT2APTGS1
SCHEMBL29387100 0.78 HDAC6 (0.56) HDAC6MAOABCHEKMT2APTGS1
SCHEMBL17356846 0.77 MAPT (0.39) HDAC6ALDH1A1MAPTPKMKMT2A
SCHEMBL4243905 0.76 HDAC6 (0.54) HDAC6MAOABCHEKMT2AACHE
SCHEMBL19151907 0.76 HDAC6 (0.54) HDAC6MAOAALDH1A1BCHEKMT2A
SCHEMBL21915333 0.76 HDAC6 (0.58) HDAC6MAOAALDH1A1MAPTBCHE

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5080989-A Polycarbonate, solvent resistance EASTMAN KODAK COMPANY (US) 1992-01-14 US disclosed
US-4322487-A Composite electrically photosensitive particles for electrophoretic migration imaging process EASTMAN KODAK COMPANY (US) 1982-03-30 US disclosed