SCHEMBL24327493

SCHEMBL24327493

CS(=O)(=O)CCNC1=C(Cl)C(=O)c2c(O)ccc(O)c2C1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDC25A P30304 6/20 0.42
▸ MAPT P10636 8/20 0.40
▸ LMNA P02545 4/20 0.40
▸ HTT P42858 3/20 0.40
▸ CDC25B P30305 3/20 0.39
▸ CYP19A1 P11511 1/20 0.39
▸ GPR55 Q9Y2T6 1/20 0.38
▸ MAPK1 P28482 5/20 0.38
▸ NPSR1 Q6W5P4 4/20 0.38
▸ TDP1 Q9NUW8 5/20 0.37
▸ USP2 O75604 3/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ POLB P06746 2/20 0.37
▸ MITF O75030 2/20 0.37
▸ NSD2 O96028 4/20 0.37
▸ BLM P54132 3/20 0.37
▸ MEN1 O00255 3/20 0.37
▸ KMT2A Q03164 3/20 0.37
▸ CSNK2A2 P19784 2/20 0.37
▸ CSNK2B P67870 2/20 0.37

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
SCHEMBL24327529 0.81 MAPT (0.47) CDC25AMAPTLMNAHTTCDC25B
SCHEMBL24327930 0.80 MAPT (0.46) CDC25AMAPTLMNAHTTCDC25B
SCHEMBL24327527 0.79 CDC25A (0.46) CDC25AMAPTLMNAHTTCDC25B
SCHEMBL24327487 0.79 CDC25A (0.46) CDC25AMAPTLMNAHTTCDC25B
SCHEMBL24327927 0.79 CDC25A (0.46) CDC25AMAPTLMNAHTTCDC25B
SCHEMBL24327489 0.76 CDC25A (0.40) CDC25AMAPTLMNAHTTCDC25B
SCHEMBL24327928 0.74 HKDC1 (0.49) CDC25AMAPTLMNAHTTCDC25B
SCHEMBL24327495 0.74 NSD2 (0.49) CDC25AMAPTLMNAHTTCDC25B
SCHEMBL24328014 0.72 OXTR (0.42) CDC25AMAPTLMNAHTTGPR55
SCHEMBL197302 0.71 GPR55 (0.55) MAPTLMNAHTTCDC25BCYP19A1

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-2022081984-A1 METHODS AND COMPOUNDS TO TREAT SARS INFECTIONS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2022-04-21 — — WO disclosed
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