SCHEMBL24813822

SCHEMBL24813822

Cc1cccc(N=Nc2ccc(N3C(=O)c4ccc5c6ccc7c8c(ccc(c9ccc(c4c59)C3=O)c86)C(=O)N(c3ccc(N=Nc4cccc(S(=O)(=O)O)c4)cc3)C7=O)cc2)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.40
▸ ENPP2 Q13822 2/20 0.40
▸ KMT2A Q03164 4/20 0.39
▸ MEN1 O00255 3/20 0.39
▸ USP2 O75604 3/20 0.39
▸ KEAP1 Q14145 2/20 0.39
▸ NFE2L2 Q16236 2/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ CA9 Q16790 7/20 0.39
▸ CA2 P00918 6/20 0.39
▸ CA12 O43570 5/20 0.39
▸ CA1 P00915 4/20 0.39
▸ SENP3 Q9H4L4 2/20 0.39
▸ SENP2 Q9HC62 2/20 0.39
▸ SENP1 Q9P0U3 2/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ SUMO2 P61956 1/20 0.39
▸ SUMO1 P63165 1/20 0.39
▸ SENP7 Q9BQF6 1/20 0.39
▸ MAPT P10636 3/20 0.38

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
SCHEMBL24812144 0.94 CA12 (0.43) ALDH1A1ENPP2KMT2AMEN1USP2
SCHEMBL26560959 0.94 CA12 (0.43) ALDH1A1ENPP2KMT2AMEN1USP2
SCHEMBL24813825 0.92 POLB (0.45) ALDH1A1ENPP2KMT2AMEN1USP2
SCHEMBL24813823 0.91 SENP3 (0.41) ALDH1A1ENPP2KMT2AMEN1USP2
SCHEMBL24813820 0.89 CA12 (0.47) ALDH1A1ENPP2KMT2AMEN1USP2
SCHEMBL12126991 0.82 MEN1 (0.54) ALDH1A1KMT2AMEN1USP2KEAP1
SCHEMBL24813821 0.79 BCL2 (0.45) ENPP2KMT2AMEN1CA9CA2
SCHEMBL24812534 0.78 KMT2A (0.41) ALDH1A1KMT2AMEN1CA9CA2
SCHEMBL24812145 0.78 POLB (0.45) ALDH1A1ENPP2KMT2AMEN1USP2
SCHEMBL15381852 0.77 NPC1 (0.51) ALDH1A1KMT2AMEN1USP2KEAP1

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-2022270182-A1 POSITIVE PHOTOSENSITIVE PIGMENT COMPOSITION, CURED FILM CONTAINING CURED PRODUCT THEREOF, AND ORGANIC EL DISPLAY DEVICE 東レ株式会社 2022-12-29 — — WO disclosed
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