SCHEMBL14979312

SCHEMBL14979312

c1ccc(-c2cccc(-c3ccccc3-c3cnc(-n4c5ccccc5c5ccc6ccccc6c54)nc3)c2)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DUSP3 P51452 1/20 0.34
MET P08581 2/20 0.33
TNF P01375 1/20 0.33
TUBB4A P04350 1/20 0.32
TUBB P07437 1/20 0.32
TUBA3C P0DPH7 1/20 0.32
TUBA1B P68363 1/20 0.32
TUBA4A P68366 1/20 0.32
TUBB4B P68371 1/20 0.32
TUBB3 Q13509 1/20 0.32
TUBB2A Q13885 1/20 0.32
TUBB8 Q3ZCM7 1/20 0.32
TUBA3E Q6PEY2 1/20 0.32
TUBA1A Q71U36 1/20 0.32
TUBA1C Q9BQE3 1/20 0.32
TUBB6 Q9BUF5 1/20 0.32
TUBB2B Q9BVA1 1/20 0.32
TUBB1 Q9H4B7 1/20 0.32
MAPT P10636 2/20 0.32
SMN1; SMN2 Q16637 2/20 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
SCHEMBL14979358 0.93 NPC1 (0.35) DUSP3METMAPTSMN1; SMN2NPC1
SCHEMBL14979314 0.92 FGFR1 (0.35) METMAPTSMN1; SMN2NPC1LMNA
SCHEMBL14979316 0.92 TNF (0.35) DUSP3METTNFMAPTSMN1; SMN2
SCHEMBL14979313 0.89 TNF (0.35) DUSP3TNFMAPTSMN1; SMN2NPC1
SCHEMBL14979394 0.89 TNF (0.35) DUSP3TNFMAPTSMN1; SMN2NPC1
SCHEMBL14979401 0.88 NPC1 (0.35) METTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL14979397 0.88 NPC1 (0.35) METTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL14979415 0.87 MAPK10 (0.33) MAPTSMN1; SMN2NPC1LMNARECQL
SCHEMBL14979391 0.87 MAPK10 (0.33) MAPTSMN1; SMN2NPC1LMNARECQL
SCHEMBL14979357 0.86 NPC1 (0.37) DUSP3MAPTSMN1; SMN2NPC1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140316136-A1 NOVEL ORGANIC ELECTROLUMINESCENCE COMPOUNDS AND ORGANIC ELECTROLUMINESCENCE DEVICE COMPRISING SAME ROHM & HAAS ELECT MAT (KR) 2014-10-23 US disclosed
US-20140316136-A1 NOVEL ORGANIC ELECTROLUMINESCENCE COMPOUNDS AND ORGANIC ELECTROLUMINESCENCE DEVICE COMPRISING SAME ROHM & HAAS ELECT MAT (KR) 2014-10-23 US disclosed
WO-2013073859-A1 NOVEL ORGANIC ELECTROLUMINESCENCE COMPOUNDS AND ORGANIC ELECTROLUMINESCENCE DEVICE COMPRISING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2013-05-23 WO disclosed