SCHEMBL24036604

SCHEMBL24036604

c1ccc(-c2ccc(-c3nc(-c4ccc(-c5ccccc5)cc4)nc(-c4ccc(-n5c6ccc(-c7ccccc7)cc6c6c7ccccc7c(-c7ccccc7)cc65)cc4)n3)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.36
KDM4E B2RXH2 2/20 0.36
ATM Q13315 2/20 0.36
NR3C1 P04150 1/20 0.35
MAPT P10636 3/20 0.35
ALDH1A1 P00352 2/20 0.35
HPGD P15428 2/20 0.35
MAPK1 P28482 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
RXRA P19793 1/20 0.34
CAMKK2 Q96RR4 1/20 0.34
HSP90AA1 P07900 1/20 0.33
AVPR1A P37288 1/20 0.33
ALK Q9UM73 1/20 0.32
TSPO P30536 1/20 0.32
HDAC4 P56524 1/20 0.32
PIK3CA P42336 1/20 0.32
ACACA Q13085 1/20 0.32

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
SCHEMBL22174533 0.95 L3MBTL1 (0.39) L3MBTL1KDM4EATMMAPTALDH1A1
SCHEMBL16785782 0.91 MEN1 (0.35) L3MBTL1KDM4EATMNR3C1MAPT
SCHEMBL18333580 0.89 ALDH1A1 (0.39) L3MBTL1KDM4EATMMAPTALDH1A1
SCHEMBL16785798 0.88 L3MBTL1 (0.46) L3MBTL1KDM4EATMMAPTALDH1A1
SCHEMBL23740396 0.88 PTGER4 (0.33) L3MBTL1KDM4ENR3C1MAPTALDH1A1
SCHEMBL23740505 0.88 PTGER4 (0.33) L3MBTL1KDM4ENR3C1MAPTALDH1A1
SCHEMBL14979519 0.87 KDM4E (0.36) L3MBTL1KDM4EATMMAPTALDH1A1
SCHEMBL14979520 0.87 KDM4E (0.36) L3MBTL1KDM4EATMMAPTALDH1A1
SCHEMBL22387050 0.87 CAMKK2 (0.36) L3MBTL1KDM4EATMNR3C1MAPT
SCHEMBL22387023 0.87 CAMKK2 (0.36) L3MBTL1KDM4EATMNR3C1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021230651-A1 ORGANIC ELECTRONIC ELEMENT COMPRISING COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2021-11-18 WO disclosed