SCHEMBL27680859

SCHEMBL27680859

CC(=O)C(Cl)Cc1cccc(NS(=O)(=O)c2ccc(C)cc2)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.54
▸ TCF4 P15884 1/20 0.53
▸ CTNNB1 P35222 1/20 0.53
▸ MEN1 O00255 3/20 0.49
▸ KMT2A Q03164 3/20 0.49
▸ IKBKB O14920 1/20 0.49
▸ FFAR1 O14842 1/20 0.49
▸ CDK1 P06493 1/20 0.49
▸ CCNB1 P14635 1/20 0.49
▸ CCNA2 P20248 1/20 0.49
▸ CDK2 P24941 1/20 0.49
▸ CDK7 P50613 1/20 0.49
▸ CCNH P51946 1/20 0.49
▸ CCNA1 P78396 1/20 0.49
▸ FFAR4 Q5NUL3 1/20 0.49
▸ CA12 O43570 1/20 0.49
▸ CA1 P00915 1/20 0.49
▸ CA2 P00918 1/20 0.49
▸ CA9 Q16790 1/20 0.49
▸ KDM1A O60341 2/20 0.48

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
SCHEMBL8269562 0.78 TP53 (0.64) ALDH1A1TCF4CTNNB1MEN1KMT2A
SCHEMBL27653427 0.77 HTR6 (0.76) ALDH1A1TCF4CTNNB1MEN1KMT2A
SCHEMBL28161888 0.76 ALDH1A1 (0.54) ALDH1A1TCF4CTNNB1MEN1KMT2A
SCHEMBL13028543 0.76 IKBKB (0.68) ALDH1A1TCF4CTNNB1MEN1KMT2A
SCHEMBL14877794 0.76 CA12 (0.76) ALDH1A1TCF4CTNNB1MEN1KMT2A
SCHEMBL396993 0.75 ALDH1A1 (0.58) ALDH1A1TCF4CTNNB1MEN1KMT2A
SCHEMBL3562390 0.75 POLB (0.62) ALDH1A1TCF4CTNNB1MEN1KMT2A
SCHEMBL6959526 0.74 TCF4 (0.75) ALDH1A1TCF4CTNNB1MEN1KMT2A
SCHEMBL3556021 0.74 KDM1A (0.59) ALDH1A1TCF4CTNNB1MEN1KMT2A
SCHEMBL397234 0.73 MEN1 (0.56) ALDH1A1TCF4CTNNB1MEN1KMT2A

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
CN-101052646-B Cell cycle phase markers GE HEALTHCARE UK LTD. (GB) 2015-10-21 — — CN disclosed
CN-101052646-A Cell cycle phase markers GE HEALTHCARE UK LTD (GB) 2007-10-10 — — CN disclosed
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