SCHEMBL12613101

SCHEMBL12613101

c1ccc2c(c1)oc1c(-c3ccc(-c4c5ccccc5c(-c5cn6ccccc6n5)c5ccccc45)cc3)cccc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 16/20 0.44
▸ NPC1 O15118 15/20 0.44
▸ ALDH1A1 P00352 8/20 0.44
▸ PKM P14618 7/20 0.44
▸ MAPT P10636 4/20 0.44
▸ LMNA P02545 1/20 0.44
▸ ALOX5 P09917 1/20 0.43
▸ KDM4E B2RXH2 10/20 0.42
▸ POLB P06746 3/20 0.42
▸ GFER P55789 3/20 0.41
▸ SMN1; SMN2 Q16637 8/20 0.41
▸ KMT2A Q03164 2/20 0.40
▸ EPHX2 P34913 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ MIF P14174 1/20 0.40
▸ HPGD P15428 3/20 0.39
▸ HDAC6 Q9UBN7 1/20 0.39
▸ MAPK1 P28482 2/20 0.38
▸ TP53 P04637 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
SCHEMBL12613319 0.91 RAB9A (0.45) RAB9ANPC1ALDH1A1PKMMAPT
SCHEMBL25150465 0.85 RAB9A (0.46) RAB9ANPC1ALDH1A1PKMMAPT
SCHEMBL12612701 0.83 RAB9A (0.46) RAB9ANPC1ALDH1A1PKMMAPT
SCHEMBL25789185 0.82 RAB9A (0.45) RAB9ANPC1ALDH1A1PKMMAPT
SCHEMBL15393861 0.81 RAB9A (0.51) RAB9ANPC1ALDH1A1PKMMAPT
SCHEMBL15393956 0.80 RAB9A (0.50) RAB9ANPC1ALDH1A1PKMMAPT
SCHEMBL15394288 0.79 RAB9A (0.52) RAB9ANPC1ALDH1A1PKMMAPT
SCHEMBL125801 0.79 ALOX5 (0.62) ALOX5
SCHEMBL15393848 0.78 RAB9A (0.46) RAB9ANPC1ALDH1A1PKMMAPT
SCHEMBL15394238 0.78 RAB9A (0.51) RAB9ANPC1ALDH1A1PKMMAPT

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
US-8502201-B2 Light-emitting element TORAY INDUSTRIES, INC. (JP) 2013-08-06 — — US disclosed
US-8502201-B2 Light-emitting element TORAY INDUSTRIES, INC. (JP) 2013-08-06 — — US disclosed
US-20110121268-A1 LIGHT-EMITTING ELEMENT TORAY INDUSTRIES, INC. (JP) 2011-05-26 — — US disclosed
US-20110121268-A1 LIGHT-EMITTING ELEMENT TORAY INDUSTRIES, INC. (JP) 2011-05-26 — — US disclosed
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