SCHEMBL18334158

SCHEMBL18334158

c1ccc(-c2nc(-c3ccccc3)nc(-c3c4ccccc4c(-c4ccc(-c5cc(-c6ccccn6)nc(-c6ccccn6)c5)c5ccccc45)c4ccccc34)n2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CCR1 P32246 3/20 0.45
▸ CCR5 P51681 3/20 0.45
▸ CCR8 P51685 3/20 0.45
▸ KDM4E B2RXH2 5/20 0.41
▸ ADORA3 P0DMS8 3/20 0.41
▸ RXFP1 Q9HBX9 1/20 0.41
▸ MAPK1 P28482 2/20 0.41
▸ TSHR P16473 2/20 0.41
▸ HSD17B10 Q99714 2/20 0.41
▸ SMN1; SMN2 Q16637 4/20 0.40
▸ TDP1 Q9NUW8 3/20 0.40
▸ TP53 P04637 3/20 0.40
▸ LMNA P02545 3/20 0.40
▸ ALPL P05186 1/20 0.40
▸ HSP90AA1 P07900 1/20 0.40
▸ ALPI P09923 1/20 0.40
▸ ALPG P10696 1/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL18334163 0.94 CCR1 (0.44) CCR1CCR5CCR8KDM4EADORA3
SCHEMBL18334157 0.91 CCR1 (0.42) CCR1CCR5CCR8KDM4EADORA3
SCHEMBL18334159 0.90 CCR1 (0.45) CCR1CCR5CCR8KDM4EADORA3
SCHEMBL18675709 0.89 CCR1 (0.46) CCR1CCR5CCR8KDM4EADORA3
SCHEMBL18680019 0.89 CCR1 (0.46) CCR1CCR5CCR8KDM4EADORA3
SCHEMBL20010304 0.88 CCR1 (0.45) CCR1CCR5CCR8KDM4EADORA3
SCHEMBL18334153 0.88 CCR1 (0.49) CCR1CCR5CCR8KDM4EADORA3
SCHEMBL18675735 0.88 KDM4E (0.47) CCR1CCR5CCR8KDM4EADORA3
SCHEMBL18679997 0.86 METAP1 (0.44) CCR1CCR5CCR8KDM4EADORA3
SCHEMBL18679984 0.86 KDM4E (0.46) CCR1CCR5CCR8KDM4EADORA3

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
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