SCHEMBL18119034

SCHEMBL18119034

Cc1nc(-c2ccc(-c3cccc4ccccc34)cc2)c2ccccc2n1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 5/20 0.49
ENPP3 O14638 1/20 0.49
ENPP1 P22413 1/20 0.49
KDM4E B2RXH2 1/20 0.49
ALDH1A1 P00352 1/20 0.49
NUDT1 P36639 3/20 0.44
PPARG P37231 5/20 0.43
PPARA Q07869 5/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
PPARD Q03181 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
ATM Q13315 1/20 0.42
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA9 Q16790 1/20 0.42
FLT3 P36888 1/20 0.41
TNF P01375 1/20 0.41

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
SCHEMBL24689399 0.89 ADORA2A (0.53) ADORA2AKDM4EALDH1A1NUDT1MEN1
SCHEMBL23946295 0.88 MCL1 (0.42) ADORA2AENPP3ENPP1KDM4EALDH1A1
SCHEMBL16542822 0.87 ADORA2A (0.50) ADORA2AENPP3ENPP1KDM4EALDH1A1
SCHEMBL29985983 0.87 ADORA2A (0.50) ADORA2AENPP3ENPP1KDM4EALDH1A1
SCHEMBL23946293 0.87 ALDH1A1 (0.44) ADORA2AENPP3ENPP1KDM4EALDH1A1
SCHEMBL16542819 0.83 ADORA2A (0.57) ADORA2AKDM4EALDH1A1NUDT1MEN1
SCHEMBL29986553 0.83 ADORA2A (0.57) ADORA2AKDM4EALDH1A1NUDT1MEN1
SCHEMBL1773091 0.83 NUDT1 (0.60) ADORA2AKDM4EALDH1A1NUDT1MEN1
SCHEMBL21667647 0.83 ATM (0.62) ADORA2AENPP3ENPP1KDM4EALDH1A1
SCHEMBL23946297 0.82 KCNH2 (0.41) ADORA2AENPP3ENPP1KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10032994-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2018-07-24 US disclosed
US-20170125698-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2017-05-04 US disclosed
US-20170125691-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2017-05-04 US disclosed
US-20170117483-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2017-04-27 US disclosed
US-20170054085-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2017-02-23 US disclosed
US-20160293845-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-10-06 US disclosed