SCHEMBL27117828

SCHEMBL27117828

CCOC(=O)c1nn(-c2cc(Cl)cc(Cl)c2)c2c1OCc1cc(OC)c(Br)cc1-2

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.39
▸ KCNK3 O14649 2/20 0.39
▸ CCNA2 P20248 2/20 0.38
▸ CDK2 P24941 2/20 0.38
▸ CCNA1 P78396 2/20 0.38
▸ ALDH1A1 P00352 3/20 0.37
▸ NPSR1 Q6W5P4 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ PDE4D Q08499 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ NPBWR1 P48145 1/20 0.35
▸ MAOB P27338 1/20 0.34
▸ CA1 P00915 1/20 0.34
▸ CA2 P00918 1/20 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
SCHEMBL30759541 1.00 L3MBTL1 (0.39) L3MBTL1KCNK3CCNA2CDK2CCNA1
SCHEMBL31236969 0.92 KCNK3 (0.41) L3MBTL1KCNK3CCNA2CDK2CCNA1
SCHEMBL30759474 0.88 MAPT (0.34) L3MBTL1CCNA2CDK2CCNA1KDM4E
SCHEMBL27117850 0.88 MAPT (0.34) L3MBTL1CCNA2CDK2CCNA1KDM4E
SCHEMBL30759600 0.84 CCNA2 (0.47) L3MBTL1KCNK3CCNA2CDK2CCNA1
SCHEMBL27119351 0.84 CCNA2 (0.47) L3MBTL1KCNK3CCNA2CDK2CCNA1
SCHEMBL27118701 0.84 CCNA2 (0.43) L3MBTL1KCNK3CCNA2CDK2CCNA1
SCHEMBL17381607 0.82 CCNA2 (0.43) L3MBTL1CCNA2CDK2CCNA1ALDH1A1
SCHEMBL30759630 0.82 L3MBTL1 (0.39) L3MBTL1KCNK3CCNA2CDK2CCNA1
SCHEMBL29538955 0.82 CCNA2 (0.43) L3MBTL1CCNA2CDK2CCNA1ALDH1A1

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-2024044778-A2 NOVEL MODULATORS OF FSHR AND USES THEREOF CELMATIX INC. (US) 2024-02-29 — — WO disclosed
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