SCHEMBL17808652

SCHEMBL17808652

c1ccc(-c2nc(-c3ccccc3)nc(-c3cc(-c4cccc(-n5c6ccccc6c6cccnc65)c4)cc(-c4ccc5ccc6cccnc6c5n4)c3)n2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.36
ALDH1A1 P00352 1/20 0.36
CYP2C19 P33261 1/20 0.36
AKT1 P31749 1/20 0.32
NPSR1 Q6W5P4 1/20 0.31
GRM5 P41594 2/20 0.31
KDR P35968 1/20 0.31
TOP1 P11387 1/20 0.31
PDE4A P27815 2/20 0.30
PDE4B Q07343 2/20 0.30
PDE4C Q08493 2/20 0.30
PDE4D Q08499 2/20 0.30
FEN1 P39748 1/20 0.30
HTT P42858 2/20 0.30
KDM4E B2RXH2 1/20 0.30
GMNN O75496 1/20 0.30
LMNA P02545 1/20 0.30
TP53 P04637 1/20 0.30
HSP90AA1 P07900 1/20 0.30
MMP2 P08253 1/20 0.30

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
SCHEMBL19486642 0.86 TOP1 (0.34) TSHRALDH1A1NPSR1TOP1HTT
SCHEMBL17808654 0.83 MEN1 (0.32) TSHRALDH1A1CYP2C19LMNA
SCHEMBL17124084 0.82 ALDH1A1 (0.47) TSHRALDH1A1CYP2C19AKT1PDE4A
SCHEMBL17808649 0.81 KDM4E (0.43) TSHRALDH1A1TOP1PDE4APDE4C
SCHEMBL19486808 0.81 TOP1 (0.35) TSHRALDH1A1CYP2C19NPSR1TOP1
SCHEMBL17808647 0.81 MEN1 (0.32) TSHRALDH1A1CYP2C19TOP1LMNA
SCHEMBL17853637 0.80 TOP1 (0.39) TSHRALDH1A1NPSR1TOP1PDE4A
SCHEMBL19486570 0.80 TOP1 (0.36) TSHRALDH1A1NPSR1TOP1PDE4A
SCHEMBL24450399 0.80 PIK3CA (0.34) TSHRALDH1A1CYP2C19
SCHEMBL17124103 0.79 TSHR (0.40) TSHRALDH1A1CYP2C19AKT1TOP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9893298-B2 Organic light emitting display device LG DISPLAY CO., LTD. (KR) 2018-02-13 US disclosed
US-9893298-B2 Organic light emitting display device LG DISPLAY CO., LTD. (KR) 2018-02-13 US disclosed
EP-3032605-A1 ORGANIC LIGHT EMITTING DISPLAY DEVICE LG Display Co., Ltd. (KR) 2016-06-15 EP disclosed
US-20160164004-A1 ORGANIC LIGHT EMITTING DISPLAY DEVICE LG DISPLAY CO., LTD. (KR) 2016-06-09 US disclosed
US-20160164004-A1 ORGANIC LIGHT EMITTING DISPLAY DEVICE LG DISPLAY CO., LTD. (KR) 2016-06-09 US disclosed