SCHEMBL15439338

SCHEMBL15439338

CN(Cc1ccccc1)/N=C1\CC(=O)C/C(=N/N(C)Cc2ccccc2)C1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.42
ALDH1A1 P00352 1/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
AOC3 Q16853 1/20 0.40
KMT2A Q03164 2/20 0.39
CA12 O43570 1/20 0.39
CA9 Q16790 1/20 0.39
CA2 P00918 1/20 0.37
DDB1 Q16531 1/20 0.36
CRBN Q96SW2 1/20 0.36
CHRM2 P08172 1/20 0.36
CHRM4 P08173 1/20 0.36
CHRM5 P08912 1/20 0.36
CHRM1 P11229 1/20 0.36
CHRM3 P20309 1/20 0.36
BCHE P06276 1/20 0.36
ACHE P22303 1/20 0.36
CARM1 Q86X55 1/20 0.36
PRMT6 Q96LA8 1/20 0.36

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
SCHEMBL15439340 1.00 TSHR (0.42) TSHRALDH1A1NPC1RAB9AAOC3
SCHEMBL15438782 0.97 TSHR (0.42) TSHRALDH1A1NPC1RAB9AAOC3
SCHEMBL15439435 0.84 KMT2A (0.40) TSHRALDH1A1NPC1RAB9AAOC3
SCHEMBL15439438 0.84 KMT2A (0.40) TSHRALDH1A1NPC1RAB9AAOC3
SCHEMBL15438966 0.83 TSHR (0.42) TSHRALDH1A1NPC1RAB9AAOC3
SCHEMBL15438519 0.83 G6PC1 (0.43) TSHRALDH1A1NPC1RAB9AAOC3
SCHEMBL15438517 0.83 G6PC1 (0.43) TSHRALDH1A1NPC1RAB9AAOC3
SCHEMBL15440333 0.82 ALDH1A1 (0.50) TSHRALDH1A1NPC1RAB9AKMT2A
SCHEMBL15440335 0.82 ALDH1A1 (0.50) TSHRALDH1A1NPC1RAB9AKMT2A
SCHEMBL15439801 0.80 NPC1 (0.36) TSHRALDH1A1NPC1RAB9AAOC3

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-9115231-B2 Polymers functionalized with protected hydrazone compounds containing an acyl group BRIDGESTONE CORPORATION (JP) 2015-08-25 US disclosed
US-20140031488-A1 Polymers Functionalized With Protected Hydrazone Compounds Containing An Acyl Group BRIDGESTONE CORPORATION (JP) 2014-01-30 US disclosed