SCHEMBL17320798

SCHEMBL17320798

c1ccc(-c2c3ccccc3c(-c3ccc4c(-c5cncc(-c6ccccn6)c5)cccc4c3)c3ccccc23)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 1/20 0.40
HPGD P15428 4/20 0.38
KDM4E B2RXH2 3/20 0.38
ALDH1A1 P00352 3/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
MAPK1 P28482 2/20 0.38
HSD17B10 Q99714 2/20 0.38
MAPT P10636 2/20 0.38
NPC1 O15118 2/20 0.38
TP53 P04637 1/20 0.38
TNF P01375 1/20 0.38
LMNA P02545 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
CYP11B1 P15538 1/20 0.37
DHODH Q02127 1/20 0.37
HTR2C P28335 1/20 0.37
TGFBR1 P36897 1/20 0.36
DCTPP1 Q9H773 1/20 0.36
IDO1 P14902 1/20 0.36

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
SCHEMBL17320789 0.88 CYP2A6 (0.46) CYP2A6HPGDKDM4EALDH1A1SMN1; SMN2
SCHEMBL17320822 0.84 PDGFRB (0.39) CYP2A6HPGDKDM4EALDH1A1SMN1; SMN2
SCHEMBL13015754 0.84 CYP11B1 (0.47) CYP2A6HPGDKDM4EALDH1A1SMN1; SMN2
SCHEMBL17320823 0.83 CYP2A6 (0.39) CYP2A6HPGDKDM4EALDH1A1SMN1; SMN2
SCHEMBL17320751 0.83 CYP2A6 (0.49) CYP2A6HPGDKDM4EALDH1A1SMN1; SMN2
SCHEMBL13016100 0.82 KDM4E (0.45) CYP2A6KDM4EALDH1A1SMN1; SMN2HSD17B10
SCHEMBL10030063 0.82 KDM4E (0.45) HPGDKDM4EALDH1A1SMN1; SMN2MAPK1
SCHEMBL18563322 0.81 HSD17B10 (0.44) HPGDKDM4EALDH1A1SMN1; SMN2MAPK1
SCHEMBL24813335 0.81 CYP11B1 (0.44) CYP2A6HPGDKDM4EALDH1A1SMN1; SMN2
SCHEMBL16812818 0.80 CYP2A6 (0.48) CYP2A6HPGDKDM4EALDH1A1SMN1; 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10347842-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2019-07-09 US disclosed
US-20180138417-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO LTD (KR) 2018-05-17 US disclosed
US-20180138417-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO LTD (KR) 2018-05-17 US disclosed
US-9893289-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2018-02-13 US disclosed
US-9893289-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2018-02-13 US disclosed
US-20150357574-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2015-12-10 US disclosed
US-20150357574-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2015-12-10 US disclosed