SCHEMBL17521985

SCHEMBL17521985

c1ccc2c(-c3ccc(-c4ccc5ccc6cccnc6c5n4)c4ccccc34)cccc2c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.52
MAPT P10636 6/20 0.52
SMN1; SMN2 Q16637 5/20 0.52
CCR1 P32246 4/20 0.52
CCR8 P51685 4/20 0.52
LMNA P02545 3/20 0.52
TP53 P04637 3/20 0.52
TSHR P16473 3/20 0.52
CYP3A4 P08684 2/20 0.52
CCR5 P51681 2/20 0.52
MMP2 P08253 2/20 0.52
ALOX15 P16050 2/20 0.52
HTT P42858 2/20 0.52
TDP1 Q9NUW8 2/20 0.52
GMNN O75496 1/20 0.52
HSP90AA1 P07900 1/20 0.52
CYP2D6 P10635 1/20 0.52
MMP9 P14780 1/20 0.52
NFKB1 P19838 1/20 0.52
MMP8 P22894 1/20 0.52

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
SCHEMBL30514702 0.97 KDM4E (0.55) KDM4EMAPTSMN1; SMN2CCR1CCR8
SCHEMBL17521999 0.97 KDM4E (0.55) KDM4EMAPTSMN1; SMN2CCR1CCR8
SCHEMBL19767983 0.94 KDM4E (0.52) KDM4EMAPTSMN1; SMN2CCR1CCR8
SCHEMBL17521989 0.92 KDM4E (0.47) KDM4EMAPTSMN1; SMN2CCR1CCR8
SCHEMBL25766686 0.92 KDM4E (0.47) KDM4EMAPTSMN1; SMN2CCR1CCR8
SCHEMBL13311147 0.92 CCR1 (0.61) KDM4EMAPTSMN1; SMN2CCR1CCR8
SCHEMBL29342328 0.92 CCR1 (0.61) KDM4EMAPTSMN1; SMN2CCR1CCR8
SCHEMBL10032295 0.90 ALDH1A1 (0.49) KDM4EMAPTSMN1; SMN2TP53TSHR
SCHEMBL17522046 0.90 KDM4E (0.44) KDM4EMAPTSMN1; SMN2CCR1CCR8
SCHEMBL19762984 0.90 CCR1 (0.44) KDM4EMAPTSMN1; SMN2CCR1CCR8

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-20160043327-A1 ORGANIC LIGHT EMITTING DISPLAY DEVICE LG DISPLAY CO., LTD. (KR) 2016-02-11 US disclosed
US-20160043327-A1 ORGANIC LIGHT EMITTING DISPLAY DEVICE LG DISPLAY CO., LTD. (KR) 2016-02-11 US disclosed