SCHEMBL17320768

SCHEMBL17320768

c1ccc(-c2ccc(-c3c4ccccc4c(-c4ccc5ccccc5c4)c4ccccc34)c3ccc(-c4ccnc5ccccc45)cc23)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACVR1 Q04771 6/20 0.46
PIK3CA P42336 2/20 0.46
AAK1 Q2M2I8 1/20 0.41
ERN1 O75460 1/20 0.40
CAMKK1 Q8N5S9 1/20 0.39
CAMKK2 Q96RR4 1/20 0.39
CYP1A2 P05177 1/20 0.39
TGFBR1 P36897 1/20 0.39
MAPK14 Q16539 1/20 0.39
ESR1 P03372 2/20 0.39
ESR2 Q92731 2/20 0.39
KDM4E B2RXH2 1/20 0.39
NPC1 O15118 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
MAPK1 P28482 1/20 0.39
RAB9A P51151 1/20 0.39
HSD17B10 Q99714 1/20 0.39
HTR2B P41595 1/20 0.38
MTNR1A P48039 1/20 0.38

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
SCHEMBL15977435 0.90 ACVR1 (0.50) ACVR1PIK3CAAAK1ERN1CAMKK1
SCHEMBL24662791 0.89 CYP1A2 (0.48) ACVR1AAK1CYP1A2TGFBR1MAPK14
SCHEMBL15977658 0.88 PIK3CA (0.50) ACVR1PIK3CAAAK1ERN1CYP1A2
SCHEMBL18594102 0.83 ACVR1 (0.55) ACVR1PIK3CAAAK1ERN1CAMKK1
SCHEMBL25508709 0.83 GSTP1 (0.43) CYP1A2ESR1ESR2KDM4EALDH1A1
SCHEMBL10300874 0.82 ACVR1 (0.55) ACVR1PIK3CACAMKK1CAMKK2CYP1A2
SCHEMBL13556999 0.82 ACVR1 (0.55) ACVR1PIK3CACAMKK1CAMKK2CYP1A2
SCHEMBL10300882 0.82 ACVR1 (0.55) ACVR1PIK3CACAMKK1CAMKK2CYP1A2
SCHEMBL25493147 0.82 GSTP1 (0.43) CYP1A2ESR1ESR2KDM4EALDH1A1
SCHEMBL17320750 0.81 PIK3CA (0.49) PIK3CAMAPK14KDM4EALDH1A1HPGD

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