SCHEMBL22199851

SCHEMBL22199851

CC(=O)c1ccc2c(c1)C(=O)N(c1ccc(-c3ccc(N4C(=O)c5ccc(C(C)=O)cc5C4=O)cc3C(F)(F)F)c(C(F)(F)F)c1)C2=O

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ NPSR1 Q6W5P4 1/20 0.51
▸ CA9 Q16790 7/20 0.50
▸ CA1 P00915 5/20 0.50
▸ CA2 P00918 3/20 0.50
▸ CA4 P22748 3/20 0.50
▸ CA12 O43570 2/20 0.47
▸ HSD17B10 Q99714 1/20 0.46
▸ MET P08581 1/20 0.46
▸ ALDH1A1 P00352 3/20 0.45
▸ POLB P06746 2/20 0.45
▸ HPGD P15428 1/20 0.45
▸ S100B P04271 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.43
▸ MEN1 O00255 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ GFER P55789 1/20 0.43
▸ CTDSP1 Q9GZU7 1/20 0.43

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
SCHEMBL15845423 0.88 NPSR1 (0.63) NPSR1CA9CA1CA2CA4
SCHEMBL31254184 0.88 NPSR1 (0.63) NPSR1CA9CA1CA2CA4
SCHEMBL14016924 0.82 CA9 (0.64) NPSR1CA9CA1CA2CA4
SCHEMBL15397123 0.81 CA9 (0.51) NPSR1CA9CA1CA2CA12
SCHEMBL13400476 0.81 CA9 (0.51) NPSR1CA9CA1CA2CA4
SCHEMBL13600159 0.81 CA9 (0.55) NPSR1CA9CA1CA2CA4
SCHEMBL24425914 0.79 MEN1 (0.53) CA9CA1CA2CA12MEN1
SCHEMBL29906067 0.79 MEN1 (0.53) CA9CA1CA2CA12MEN1
SCHEMBL15746963 0.79 KIF11 (0.53) NPSR1POLBMEN1KMT2A
SCHEMBL23917893 0.78 ALDH1A1 (0.46) NPSR1CA9CA1CA2CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023131679-A1 POLY(ESTER-IMIDE) POLYMERS AND USES THEREOF SOLVAY SPECIALTY POLYMERS USA, LLC (US) 2023-07-13 — — WO disclosed
WO-2020141713-A1 METHOD FOR PREPARING POLYAMIC ACID COMPOSITION CONTAINING NOVEL DICARBONYL COMPOUND, POLYAMIC ACID COMPOSITION, METHOD FOR MANUFACTURING POLYAMIDE-IMIDE FILM USING SAME, AND POLYAMIDE-IMIDE FILM PRODUCED BY SAME MANUFACTURING METHOD 주식회사 대림코퍼레이션 2020-07-09 — — WO disclosed
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