SCHEMBL17680322

SCHEMBL17680322

c1cnc2c(c1)ccc1ccc(-c3ccc(-c4ccc(-c5ccc6ccc7cccc8ccc5c6c78)cc4)cc3)nc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 3/20 0.44
CCR5 P51681 3/20 0.44
CCR8 P51685 3/20 0.44
LMNA P02545 2/20 0.44
MMP2 P08253 2/20 0.44
TSHR P16473 2/20 0.44
KDM4E B2RXH2 2/20 0.44
MAPT P10636 2/20 0.44
GMNN O75496 1/20 0.44
TP53 P04637 1/20 0.44
HSP90AA1 P07900 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
MMP9 P14780 1/20 0.44
ALOX15 P16050 1/20 0.44
NFKB1 P19838 1/20 0.44
MMP8 P22894 1/20 0.44
THPO P40225 1/20 0.44
MTOR P42345 1/20 0.44
HTT P42858 1/20 0.44

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
SCHEMBL16558128 0.99 CCR1 (0.46) CCR1CCR5CCR8LMNAMMP2
SCHEMBL19768314 0.95 CCR1 (0.42) CCR1CCR5CCR8LMNAMMP2
SCHEMBL19768072 0.91 CCR1 (0.41) CCR1CCR5CCR8LMNAMMP2
SCHEMBL19762979 0.90 CCR1 (0.43) CCR1CCR5CCR8LMNAMMP2
SCHEMBL25766674 0.90 CCR1 (0.43) CCR1CCR5CCR8LMNAMMP2
SCHEMBL19768339 0.90 CCR1 (0.36) CCR1CCR5CCR8LMNAMMP2
SCHEMBL19167406 0.90 TOP1 (0.40) CCR1CCR5CCR8LMNAMMP2
SCHEMBL19768537 0.90 TOP1 (0.42) CCR1CCR5CCR8LMNAMMP2
SCHEMBL19166540 0.89 TOP1 (0.43) CCR1CCR5CCR8LMNAMMP2
SCHEMBL17491079 0.89 CCR1 (0.42) CCR1CCR5CCR8LMNAMMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9773983-B2 Organic light emitting diode device LG DISPLAY CO., LTD. (KR) 2017-09-26 US disclosed
US-9773983-B2 Organic light emitting diode device LG DISPLAY CO., LTD. (KR) 2017-09-26 US disclosed
US-20160104844-A1 ORGANIC LIGHT EMITTING DIODE DEVICE LG DISPLAY CO., LTD. (KR) 2016-04-14 US disclosed
US-20160104844-A1 ORGANIC LIGHT EMITTING DIODE DEVICE LG DISPLAY CO., LTD. (KR) 2016-04-14 US disclosed