SCHEMBL27252124

SCHEMBL27252124

N#Cc1ccc(-c2nc(-c3ccc(-c4ccccc4)cc3)nc(-c3ccc(-n4c5ccccc5c5ccc(-c6ccccc6)cc54)cc3)n2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 9/20 0.43
ABCB1 P08183 4/20 0.43
ATM Q13315 2/20 0.41
KDM4E B2RXH2 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
PIK3CD O00329 1/20 0.40
PIK3CA P42336 1/20 0.40
ABCC1 P33527 1/20 0.39
ALDH1A3 P47895 1/20 0.39
PDPK1 O15530 1/20 0.39
PGR P06401 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
TSHR P16473 1/20 0.39

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
SCHEMBL15248268 0.95 ABCG2 (0.41) ABCG2ABCB1ATMKDM4EL3MBTL1
SCHEMBL17032743 0.94 CYP1A2 (0.42) ABCG2ABCB1ATMKDM4EL3MBTL1
SCHEMBL17032744 0.94 CYP1A2 (0.42) ABCG2ABCB1ATMKDM4EL3MBTL1
SCHEMBL21395956 0.94 ABCG2 (0.46) ABCG2ABCB1ATMMEN1KMT2A
SCHEMBL17714824 0.93 CYP1A2 (0.41) ABCG2ABCB1ATMKDM4EL3MBTL1
SCHEMBL17034429 0.93 ALDH1A1 (0.38) ABCG2ABCB1ATMKDM4EL3MBTL1
SCHEMBL12094579 0.93 ABCG2 (0.40) ABCG2ABCB1ATMKDM4EL3MBTL1
SCHEMBL21395954 0.93 ABCG2 (0.45) ABCG2ABCB1ATMMEN1KMT2A
SCHEMBL17032738 0.93 CYP1A2 (0.43) ABCG2ABCB1ATMKDM4EL3MBTL1
SCHEMBL15305773 0.92 ABCG2 (0.39) ABCG2ABCB1ATMKDM4EL3MBTL1

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
WO-2024144176-A1 COMPOSITION FOR OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY APPARATUS 삼성에스디아이 주식회사 2024-07-04 WO disclosed
WO-2024128697-A1 COMPOSITION FOR OPTOELECTRONIC DEVICE AND ORGANIC OPTOELECTRONIC DEVICE AND DISPLAY DEVICE 삼성에스디아이 주식회사 2024-06-20 WO disclosed