SCHEMBL12380317

SCHEMBL12380317

CC(C)(C)c1cc2ccc3c(-c4ccccc4)cc(-c4ccc(-c5ccc6c(c5)oc5ccccc56)cc4)c4ccc(c1)c2c34

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.38
▸ MAPT P10636 2/20 0.38
▸ MMP12 P39900 1/20 0.37
▸ MMP13 P45452 1/20 0.37
▸ HCRTR1 O43613 1/20 0.36
▸ AHR P35869 2/20 0.35
▸ GPR84 Q9NQS5 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ PLA2G2A P14555 2/20 0.34
▸ PLA2G4A P47712 2/20 0.34
▸ NPC1 O15118 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ HSD11B1 P28845 1/20 0.33
▸ CYP1A1 P04798 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ CYP1B1 Q16678 1/20 0.32

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
SCHEMBL12380308 0.96 MAPT (0.38) ALDH1A1MAPTMMP12MMP13HCRTR1
SCHEMBL12380281 0.96 MAPT (0.36) ALDH1A1MAPTMMP12MMP13HCRTR1
SCHEMBL12380324 0.95 ALDH1A1 (0.41) ALDH1A1MAPTMMP12MMP13HCRTR1
SCHEMBL9920795 0.95 ALDH1A1 (0.39) ALDH1A1MAPTMMP12MMP13GPR84
SCHEMBL12380315 0.94 ALDH1A1 (0.39) ALDH1A1MAPTMMP12MMP13AHR
SCHEMBL12380307 0.93 ALDH1A1 (0.39) ALDH1A1MAPTMMP12MMP13HCRTR1
SCHEMBL12380312 0.93 ALDH1A1 (0.39) ALDH1A1MAPTMMP12MMP13HCRTR1
SCHEMBL12380293 0.93 AHR (0.38) ALDH1A1MAPTMMP12MMP13HCRTR1
SCHEMBL9920793 0.93 ALDH1A1 (0.36) ALDH1A1MAPTGPR84HPGDCYP1A1
SCHEMBL12380334 0.92 ALDH1A1 (0.34) ALDH1A1MAPTMMP12MMP13HCRTR1

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 6 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-7989802-B2 Light emitting device material and light emitting device TORAY INDUSTRIES, INC. (JP) 2011-08-02 — — 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
US-20100038634-A1 LIGHT EMITTING DEVICE MATERIAL AND LIGHT EMITTING DEVICE TORAY INDUSTRIES, INC. (JP) 2010-02-18 — — US disclosed
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