SCHEMBL25880850

SCHEMBL25880850

c1ccc(-c2ccc(N(c3ccc(-c4cccc5ccccc45)cc3)c3ccc(-c4cc5sc6ccccc6c5c5ccccc45)cc3)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ F9 P00740 1/20 0.40
▸ CA12 O43570 3/20 0.40
▸ CA1 P00915 3/20 0.40
▸ CA2 P00918 3/20 0.40
▸ CA9 Q16790 3/20 0.40
▸ KDM4E B2RXH2 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ MPI P34949 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ MCL1 Q07820 1/20 0.35
▸ ACMSD Q8TDX5 1/20 0.35
▸ SLC9A1 P19634 1/20 0.34
▸ TNF P01375 1/20 0.34
▸ HDAC8 Q9BY41 1/20 0.34
▸ HDAC6 Q9UBN7 1/20 0.34
▸ PPARG P37231 5/20 0.34
▸ PPARA Q07869 5/20 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
SCHEMBL17382706 0.96 CA12 (0.41) F9CA12CA1CA2CA9
SCHEMBL25880596 0.95 MCL1 (0.38) F9CA12CA1CA2CA9
SCHEMBL25903330 0.91 GPR3 (0.37) F9KDM4EMEN1ALDH1A1MAPT
SCHEMBL25880847 0.91 F9 (0.39) F9CA12CA1CA2CA9
SCHEMBL25884537 0.91 CA12 (0.38) F9CA12CA1CA2CA9
SCHEMBL25880363 0.90 CHEK1 (0.36) F9KDM4EMEN1ALDH1A1MAPT
SCHEMBL25881154 0.90 CHEK1 (0.36) F9KDM4EMEN1ALDH1A1MAPT
SCHEMBL17383335 0.89 CA12 (0.38) F9CA12CA1CA2CA9
SCHEMBL25137674 0.89 F9 (0.40) F9CA12CA1CA2CA9
SCHEMBL26490778 0.88 CA12 (0.38) F9CA12CA1CA2CA9

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
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