SCHEMBL17209285

SCHEMBL17209285

CC1(C)c2cc(-c3cccc4ccccc34)ccc2-c2ccc(-n3c4ccc(-c5cccc6ccccc56)cc4c4cc(-c5cccc6ccccc56)ccc43)cc21

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NTSR1 P30989 2/20 0.35
▸ MCL1 Q07820 1/20 0.35
▸ ACMSD Q8TDX5 1/20 0.35
▸ ENPP3 O14638 1/20 0.35
▸ ENPP1 P22413 1/20 0.35
▸ FLT3 P36888 2/20 0.33
▸ TUBB4A P04350 1/20 0.33
▸ TUBB P07437 1/20 0.33
▸ TUBA3C P0DPH7 1/20 0.33
▸ TUBA1B P68363 1/20 0.33
▸ TUBA4A P68366 1/20 0.33
▸ TUBB4B P68371 1/20 0.33
▸ TUBB3 Q13509 1/20 0.33
▸ TUBB2A Q13885 1/20 0.33
▸ TUBB8 Q3ZCM7 1/20 0.33
▸ TUBA3E Q6PEY2 1/20 0.33
▸ TUBA1A Q71U36 1/20 0.33
▸ TUBA1C Q9BQE3 1/20 0.33
▸ TUBB6 Q9BUF5 1/20 0.33
▸ TUBB2B Q9BVA1 1/20 0.33

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
SCHEMBL17209175 0.96 CA12 (0.38) NTSR1MCL1ACMSDENPP3ENPP1
SCHEMBL17209277 0.96 NTSR1 (0.35) NTSR1MCL1ACMSDENPP3ENPP1
SCHEMBL17209177 0.95 NTSR1 (0.37) NTSR1MCL1ACMSDENPP3ENPP1
SCHEMBL17209164 0.95 NTSR1 (0.37) NTSR1MCL1ACMSDENPP3ENPP1
SCHEMBL17209236 0.95 NTSR1 (0.37) NTSR1MCL1ACMSDENPP3ENPP1
SCHEMBL17209214 0.95 NTSR1 (0.37) NTSR1MCL1ACMSDENPP3ENPP1
SCHEMBL17209220 0.95 NTSR1 (0.37) NTSR1MCL1ACMSDENPP3ENPP1
SCHEMBL17209223 0.94 NTSR1 (0.33) NTSR1MCL1ACMSDENPP3ENPP1
SCHEMBL17209178 0.94 NTSR1 (0.33) NTSR1MCL1ACMSDENPP3ENPP1
SCHEMBL17209187 0.93 CA12 (0.39) NTSR1MCL1ACMSDENPP3ENPP1

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
WO-2016043394-A1 LIGHT EMITTING DIODE AND ELECTRONIC DEVICE COMPRISING SAME 주식회사 엘엠에스 2016-03-24 — — WO disclosed
WO-2015163584-A1 NOVEL COMPOUND AND LIGHT EMITTING ELEMENT COMPRISING SAME 주식회사 엘엠에스 2015-10-29 — — WO disclosed
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