SCHEMBL23098804

SCHEMBL23098804

Clc1ccc2c(c1)oc1cc(C3(c4ccccc4)c4ccccc4-c4ccccc43)ccc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 6/20 0.51
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
KDM4E B2RXH2 1/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
OPRK1 P41145 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ESR1 P03372 1/20 0.39
ESR2 Q92731 1/20 0.39
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
TTR P02766 1/20 0.37
CYP1A2 P05177 1/20 0.36
CYP2C19 P33261 1/20 0.36
HIF1A Q16665 1/20 0.36
PDK2 Q15119 2/20 0.35
MCL1 Q07820 1/20 0.35
CDC25A P30304 1/20 0.34
CDC25C P30307 1/20 0.34

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
SCHEMBL23098697 0.93 AHR (0.48) AHRMEN1KMT2AKDM4ELMNA
SCHEMBL24287131 0.91 AHR (0.48) AHRMEN1KMT2AKDM4ELMNA
SCHEMBL22617677 0.89 AHR (0.49) AHRMEN1KMT2AKDM4ELMNA
SCHEMBL22156165 0.89 AHR (0.46) AHRMEN1KMT2AKDM4ELMNA
SCHEMBL21975171 0.87 MEN1 (0.45) AHRMEN1KMT2AKDM4ELMNA
SCHEMBL24287127 0.87 AHR (0.47) AHRMEN1KMT2AKDM4ELMNA
SCHEMBL24287191 0.86 AHR (0.49) AHRMEN1KMT2AKDM4ELMNA
SCHEMBL23098748 0.85 AHR (0.48) AHRMEN1KMT2AKDM4ELMNA
SCHEMBL24287013 0.84 AHR (0.43) AHRMEN1KMT2AKDM4ELMNA
SCHEMBL23098691 0.84 AHR (0.49) AHRMEN1KMT2AKDM4ELMNA

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-11711978-B2 Heterocyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2023-07-25 US disclosed
US-11711978-B2 Heterocyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2023-07-25 US disclosed
US-20210083201-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2021-03-18 US disclosed