SCHEMBL18334145

SCHEMBL18334145

c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4c5ccccc5c(-c5ccc(-c6cc(-c7ccccn7)nc(-c7ccccn7)c6)cc5)c5ccccc45)cc3)n2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 3/20 0.49
CCR5 P51681 3/20 0.49
CCR8 P51685 3/20 0.49
KDM4E B2RXH2 6/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
RAB9A P51151 4/20 0.44
LMNA P02545 3/20 0.44
TP53 P04637 3/20 0.44
ALDH1A1 P00352 2/20 0.44
MAPT P10636 2/20 0.44
HPGD P15428 2/20 0.44
TSHR P16473 2/20 0.44
HSD17B10 Q99714 2/20 0.44
PKM P14618 2/20 0.44
KLF5 Q13887 1/20 0.44
ADORA3 P0DMS8 3/20 0.44
TDP1 Q9NUW8 2/20 0.43
MAPK1 P28482 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
ALPL P05186 1/20 0.43

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
SCHEMBL18334144 0.97 CCR1 (0.46) CCR1CCR5CCR8KDM4ESMN1; SMN2
SCHEMBL20010118 0.97 CCR1 (0.49) CCR1CCR5CCR8KDM4ESMN1; SMN2
SCHEMBL20010269 0.96 CCR1 (0.50) CCR1CCR5CCR8KDM4ESMN1; SMN2
SCHEMBL18334146 0.95 CCR1 (0.44) CCR1CCR5CCR8KDM4ESMN1; SMN2
SCHEMBL22761496 0.94 CCR1 (0.54) CCR1CCR5CCR8KDM4ESMN1; SMN2
SCHEMBL29809049 0.94 CCR1 (0.54) CCR1CCR5CCR8KDM4ESMN1; SMN2
SCHEMBL18334133 0.91 CCR1 (0.53) CCR1CCR5CCR8KDM4ESMN1; SMN2
SCHEMBL30624381 0.91 CCR1 (0.53) CCR1CCR5CCR8KDM4ESMN1; SMN2
SCHEMBL18334132 0.91 CCR1 (0.53) CCR1CCR5CCR8KDM4ESMN1; SMN2
SCHEMBL20010226 0.91 CCR1 (0.53) CCR1CCR5CCR8KDM4ESMN1; SMN2

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-20160372524-A1 ORGANIC LIGHT EMITTING DISPLAY DEVICE LG DISPLAY CO., LTD. (KR) 2016-12-22 US disclosed
US-20160372524-A1 ORGANIC LIGHT EMITTING DISPLAY DEVICE LG DISPLAY CO., LTD. (KR) 2016-12-22 US disclosed