SCHEMBL16622230

SCHEMBL16622230

Cc1cccc(-c2ccccc2)c1-c1nc(C)c(-c2ccccc2)nc1-c1ccccc1-c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 2/20 0.41
ADORA1 P30542 2/20 0.41
ALDH1A1 P00352 5/20 0.38
RAB9A P51151 3/20 0.38
KDM4E B2RXH2 3/20 0.38
MAPT P10636 3/20 0.38
MEN1 O00255 1/20 0.38
POLB P06746 1/20 0.38
PKM P14618 1/20 0.38
KMT2A Q03164 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
MAOB P27338 1/20 0.37
GAA P10253 2/20 0.36
MAPK1 P28482 1/20 0.36
NPC1 O15118 1/20 0.36
GLA P06280 1/20 0.36
HPGD P15428 1/20 0.36
ATM Q13315 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
SCHEMBL15256052 0.83 DPP4 (0.41) ADORA2AALDH1A1RAB9AKDM4EMAPT
SCHEMBL14307205 0.80 ALDH1A1 (0.44) ADORA2AALDH1A1RAB9AKDM4EMAPT
SCHEMBL15256056 0.78 TDP1 (0.44) ADORA2AALDH1A1RAB9AKDM4EMAPT
SCHEMBL14317959 0.77 ALDH1A1 (0.44) ADORA2AALDH1A1RAB9AKDM4EMAPT
SCHEMBL13211941 0.77 ALDH1A1 (0.47) ADORA2AALDH1A1RAB9AKDM4EMAPT
SCHEMBL16622245 0.77 RAB9A (0.44) ADORA2AADORA1ALDH1A1RAB9AKDM4E
SCHEMBL15256057 0.76 ALDH1A1 (0.41) ADORA2AADORA1ALDH1A1RAB9AKDM4E
SCHEMBL13071762 0.75 ADORA1 (0.46) ADORA2AADORA1ALDH1A1RAB9AKDM4E
SCHEMBL10205869 0.74 TDP1 (0.54) ADORA2AADORA1ALDH1A1RAB9AKDM4E
SCHEMBL10945797 0.74 KDM4E (0.54) ALDH1A1RAB9AKDM4EMAPTMEN1

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-20150214484-A1 Organometallic Complex and Light Emitting Element, Light Emitting Device, and Electronic Device Using the Organometallic Complex SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2015-07-30 US disclosed
US-8999520-B2 Organometallic complex and light emitting element, light emitting device, and electronic device using the organometallic complex SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2015-04-07 US disclosed