SCHEMBL17463149

SCHEMBL17463149

Cc1nccc(-c2cccc3ccccc23)n1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.49
KDM4E B2RXH2 2/20 0.49
HPGD P15428 2/20 0.49
CYP2A6 P11509 2/20 0.48
HTR2C P28335 5/20 0.46
HTR2A P28223 1/20 0.46
CDK2 P24941 3/20 0.44
DYRK1B Q9Y463 2/20 0.44
DYRK1A Q13627 1/20 0.44
ENPP3 O14638 1/20 0.43
ENPP1 P22413 1/20 0.43
CYP11B1 P15538 1/20 0.43
CYP11B2 P19099 1/20 0.43
NPC1 O15118 2/20 0.42
MAPT P10636 2/20 0.42
BCHE P06276 1/20 0.42
TP53 P04637 1/20 0.42
MAPK1 P28482 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HSD17B10 Q99714 1/20 0.42

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
SCHEMBL15901800 0.81 HTR2C (0.49) ALDH1A1KDM4EHPGDCYP2A6HTR2C
SCHEMBL16805034 0.79 ALDH1A1 (0.50) ALDH1A1KDM4EHPGDCYP2A6HTR2C
SCHEMBL13723846 0.79 CYP1A2 (0.46) ALDH1A1KDM4ECDK2DYRK1BDYRK1A
SCHEMBL4738230 0.79 CCNT1 (0.60) CDK2DYRK1ACCNT1CCNA2CDK9
SCHEMBL5786593 0.79 MAPT (0.43) ALDH1A1KDM4EHPGDCYP2A6HTR2C
SCHEMBL31452201 0.79 MAPT (0.43) ALDH1A1KDM4EHPGDCYP2A6HTR2C
SCHEMBL29548754 0.79 CCNT1 (0.60) CDK2DYRK1ACCNT1CCNA2CDK9
SCHEMBL25764674 0.78 CYP11B1 (0.43) ALDH1A1KDM4EHPGDCYP2A6HTR2C
SCHEMBL17819109 0.78 DYRK1A (0.49) ALDH1A1KDM4EHPGDCDK2DYRK1A
SCHEMBL18731803 0.77 MAPT (0.53) ALDH1A1KDM4EHPGDHTR2CCDK2

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-9666807-B2 Organic light emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2017-05-30 US disclosed
US-20160028017-A1 ORGANIC LIGHT EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-01-28 US disclosed