SCHEMBL26513490

SCHEMBL26513490

C#Cc1ccc(C)c(N(C)S(=O)(=O)C2CC2)c1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PIK3C3 Q8NEB9 1/20 0.36
IDH1 O75874 1/20 0.32
TYK2 P29597 1/20 0.31
CA12 O43570 2/20 0.30
CA1 P00915 2/20 0.30
CA2 P00918 2/20 0.30
CA9 Q16790 2/20 0.30
CA14 Q9ULX7 2/20 0.30
ALDH1A1 P00352 1/20 0.30
THRB P10828 1/20 0.30
CYP2C9 P11712 1/20 0.30
CA4 P22748 1/20 0.30

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
SCHEMBL24498281 0.84 PIK3C3 (0.33) PIK3C3
SCHEMBL26544512 0.82 ALDH1A1 (0.33) PIK3C3ALDH1A1
SCHEMBL26545857 0.80 POLB (0.38) PIK3C3IDH1CA12CA1CA2
SCHEMBL24497515 0.80 LMNA (0.43) PIK3C3ALDH1A1CYP2C9
SCHEMBL24498513 0.78 TSHR (0.43) PIK3C3ALDH1A1
SCHEMBL24497704 0.78 PIK3C3 (0.40) PIK3C3CYP2C9
SCHEMBL26545428 0.78 IDH1 (0.33) IDH1CA12CA1CA2CA9
SCHEMBL24497541 0.77 PIK3C3 (0.37) PIK3C3TYK2CYP2C9
SCHEMBL24497545 0.75 CYP2C9 (0.45) PIK3C3CA1CA2CYP2C9
SCHEMBL26513485 0.75 CA12 (0.41) IDH1CA12CA1CA2CA9

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
EP-4257587-A1 HYDROXAMATE COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF Shenzhen Chipscreen Biosciences Co., Ltd. (CN) 2023-10-11 EP disclosed