SCHEMBL26490394

SCHEMBL26490394

c1cc(-c2cccc(N(c3ccc4oc5cc6ccccc6cc5c4c3)c3cccc4ccccc34)c2)cc(-c2cccc3ccccc23)c1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MCL1 Q07820 1/20 0.33
▸ ACMSD Q8TDX5 1/20 0.33
▸ CA12 O43570 1/20 0.32
▸ CA1 P00915 1/20 0.32
▸ CA2 P00918 1/20 0.32
▸ CA9 Q16790 1/20 0.32
▸ ALDH1A1 P00352 3/20 0.32
▸ MAPT P10636 3/20 0.32
▸ HPGD P15428 2/20 0.32
▸ HSD17B10 Q99714 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ ALOX15 P16050 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ CASP1 P29466 1/20 0.32
▸ CASP7 P55210 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ PIM1 P11309 1/20 0.31
▸ CHRNA1 P02708 1/20 0.31
▸ CHRNG P07510 1/20 0.31

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
SCHEMBL26490381 0.98 MCL1 (0.34) MCL1ACMSDCA12CA1CA2
SCHEMBL23238014 0.93 MAPT (0.35) MCL1ACMSDCA12CA1CA2
SCHEMBL26490593 0.92 KDM4E (0.34) ALDH1A1MAPTHPGDHSD17B10KMT2A
SCHEMBL24919417 0.91 MAPT (0.36) MCL1ACMSDCA12CA1CA2
SCHEMBL27308654 0.90 CA12 (0.35) MCL1ACMSDCA12CA1CA2
SCHEMBL26490365 0.90 MCL1 (0.34) MCL1ACMSDCA12CA1CA2
SCHEMBL27307900 0.89 MCL1 (0.35) MCL1ACMSDCA12CA1CA2
SCHEMBL27308144 0.89 MCL1 (0.35) MCL1ACMSDCA12CA1CA2
SCHEMBL23237195 0.89 DUSP3 (0.35) MCL1ACMSDCA12CA1CA2
SCHEMBL26490397 0.89 CA12 (0.36) MCL1ACMSDCA12CA1CA2

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
US-20230329025-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO.,LTD. (JP) 2023-10-12 — — US disclosed
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