SCHEMBL19829496

SCHEMBL19829496

Cc1cc(-c2ccc(-c3ccc4ccc(-c5ccc(-c6cc(C)c7cccnc7n6)cc5)cc4c3)cc2)nc2ncccc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 1/20 0.41
CCR8 P51685 1/20 0.41
DHODH Q02127 2/20 0.40
SYK P43405 6/20 0.38
NPC1 O15118 3/20 0.38
RAB9A P51151 3/20 0.38
POLB P06746 1/20 0.38
ALDH1A1 P00352 2/20 0.37
MAPT P10636 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
BCHE P06276 1/20 0.37
ACHE P22303 1/20 0.37
AHR P35869 1/20 0.36
KDM4E B2RXH2 1/20 0.35
HCRTR1 O43613 1/20 0.35
LMNA P02545 1/20 0.35
GAA P10253 1/20 0.35
CYP17A1 P05093 1/20 0.35

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
SCHEMBL19829502 0.92 BCHE (0.44) CCR1CCR8DHODHSYKNPC1
SCHEMBL19829493 0.85 CCR1 (0.41) CCR1CCR8DHODHBCHEACHE
SCHEMBL15976491 0.84 ALDH1A1 (0.49) CCR1CCR8DHODHNPC1RAB9A
SCHEMBL15976490 0.75 KDM4E (0.49) CCR1CCR8NPC1RAB9APOLB
SCHEMBL14034363 0.75 KDM4E (0.56) DHODHSYKNPC1RAB9APOLB
SCHEMBL14241409 0.73 CCR1 (0.50) CCR1CCR8BCHEACHE
SCHEMBL14227400 0.72 CYP1A2 (0.52) CCR1CCR8DHODHNPC1RAB9A
SCHEMBL3378871 0.71 F2 (0.50) CCR1CCR8DHODHSYKNPC1
SCHEMBL19844328 0.71 KDM4E (0.54) DHODHPOLBALDH1A1MAPTMEN1
SCHEMBL30590402 0.71 CCR1 (0.41) CCR1CCR8NPC1BCHEACHE

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-10686150-B2 Organic light emitting device LG CHEM, LTD. (KR) 2020-06-16 US disclosed
US-20180033989-A1 ORGANIC LIGHT EMITTING DEVICE LG CHEM, LTD. (KR) 2018-02-01 US disclosed
US-20180033989-A1 ORGANIC LIGHT EMITTING DEVICE LG CHEM, LTD. (KR) 2018-02-01 US disclosed