SCHEMBL25875687

SCHEMBL25875687

CC1(C)c2ccccc2-c2cc(N(c3ccc4c(c3)C(C)(C)c3ccccc3-4)c3ccc4ccc5oc6ccccc6c5c4c3)ccc21

nearest known ligand 0.31

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 1/20 0.31
TDP1 Q9NUW8 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
NPC1 O15118 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
RAB9A P51151 1/20 0.30
KMT2A Q03164 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
PDK2 Q15119 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
SCHEMBL25875801 0.97 ALK (0.32) ALKTDP1L3MBTL1MEN1MAPT
SCHEMBL25875566 0.97 TDP1 (0.32) ALKTDP1L3MBTL1KDM4EMEN1
SCHEMBL25875797 0.94 KDM4E (0.33) ALKTDP1L3MBTL1KDM4EMEN1
SCHEMBL25875470 0.94 KDM4E (0.36) TDP1L3MBTL1KDM4EMEN1NPC1
SCHEMBL25875459 0.94 ALK (0.31) ALKTDP1L3MBTL1KDM4EMEN1
SCHEMBL25875691 0.94 PDK2 (0.33) ALKTDP1L3MBTL1PDK2
SCHEMBL25876009 0.93 CASP3 (0.31)
SCHEMBL25875469 0.93 MEN1 (0.34) TDP1L3MBTL1KDM4EMEN1NPC1
SCHEMBL25875796 0.93 TDP1 (0.32) ALKTDP1L3MBTL1KDM4EMEN1
SCHEMBL26851335 0.92 ALK (0.30) ALK

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-2023132694-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2023-07-13 WO disclosed