SCHEMBL24255943

SCHEMBL24255943

CC1(C)c2ccccc2-c2ccc(-c3ccc(N(c4ccccc4)c4nc(-c5ccc(-c6ccc7ccccc7c6)cc5)c5ccccc5n4)cc3)cc21

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NUDT1 P36639 2/20 0.39
SCN9A Q15858 3/20 0.36
KDM4E B2RXH2 2/20 0.32
ADORA2A P29274 2/20 0.32
ALDH1A1 P00352 1/20 0.31
LPL P06858 1/20 0.31
LIPG Q9Y5X9 1/20 0.31
PDK2 Q15119 1/20 0.31
KMT2A Q03164 1/20 0.30
TDP2 O95551 1/20 0.30

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
SCHEMBL21709417 0.88 NUDT1 (0.47) NUDT1SCN9AKDM4EADORA2AALDH1A1
SCHEMBL24255933 0.84 NUDT1 (0.51) NUDT1SCN9AKDM4EADORA2AALDH1A1
SCHEMBL17243446 0.82 PDK2 (0.37) LPLLIPGPDK2
SCHEMBL17243528 0.82 PDK2 (0.37) LPLLIPGPDK2
SCHEMBL17243506 0.82 PDK2 (0.37) LPLLIPGPDK2
SCHEMBL24686802 0.82 LPL (0.40) ALDH1A1LPLLIPGPDK2
SCHEMBL24687352 0.82 LPL (0.40) ALDH1A1LPLLIPGPDK2
SCHEMBL23605512 0.82 NUDT1 (0.41) NUDT1SCN9AKDM4EADORA2AALDH1A1
SCHEMBL21667456 0.81 ATM (0.42) KDM4EADORA2AALDH1A1LPLLIPG
SCHEMBL24841983 0.81 PDK2 (0.39) LPLLIPGPDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230337529-A1 ORGANIC LIGHT-EMITTING DEVICE AND COMPOSITION FOR FORMING ORGANIC MATERIAL LAYER LT MATERIALS CO., LTD. (KR) 2023-10-19 US disclosed
US-20230337529-A1 ORGANIC LIGHT-EMITTING DEVICE AND COMPOSITION FOR FORMING ORGANIC MATERIAL LAYER LT MATERIALS CO., LTD. (KR) 2023-10-19 US disclosed
WO-2022035097-A1 ORGANIC LIGHT-EMITTING DEVICE AND COMPOSITION FOR FORMING ORGANIC MATERIAL LAYER 엘티소재주식회사 2022-02-17 WO disclosed