SCHEMBL24327489

SCHEMBL24327489

O=C1C(Cl)=C(NCCC2CC2)C(=O)c2c(O)ccc(O)c21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDC25A P30304 6/20 0.40
▸ GPR55 Q9Y2T6 1/20 0.39
▸ MAPT P10636 7/20 0.38
▸ LMNA P02545 4/20 0.38
▸ HTT P42858 4/20 0.38
▸ CDC25B P30305 3/20 0.38
▸ CYP19A1 P11511 1/20 0.37
▸ EBP Q15125 1/20 0.36
▸ SIGMAR1 Q99720 1/20 0.36
▸ NSD2 O96028 5/20 0.35
▸ MAPK1 P28482 4/20 0.35
▸ TDP1 Q9NUW8 4/20 0.35
▸ MEN1 O00255 4/20 0.35
▸ KMT2A Q03164 4/20 0.35
▸ BLM P54132 3/20 0.35
▸ SMN1; SMN2 Q16637 3/20 0.35
▸ USP2 O75604 3/20 0.35
▸ TP53 P04637 2/20 0.35
▸ RECQL P46063 2/20 0.35
▸ HSP90AA1 P07900 2/20 0.35

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
SCHEMBL24327940 0.78 MEN1 (0.38) CDC25AGPR55MAPTLMNAHTT
SCHEMBL24327493 0.76 CDC25A (0.42) CDC25AGPR55MAPTLMNAHTT
SCHEMBL24327529 0.76 MAPT (0.47) CDC25AGPR55MAPTLMNAHTT
SCHEMBL24327930 0.75 MAPT (0.46) CDC25AMAPTLMNAHTTCDC25B
SCHEMBL24327527 0.73 CDC25A (0.46) CDC25AMAPTLMNAHTTCDC25B
SCHEMBL24327927 0.73 CDC25A (0.46) CDC25AMAPTLMNAHTTCDC25B
SCHEMBL24327487 0.73 CDC25A (0.46) CDC25AMAPTLMNAHTTCDC25B
SCHEMBL24327928 0.72 HKDC1 (0.49) CDC25AMAPTLMNAHTTCDC25B
SCHEMBL24327495 0.71 NSD2 (0.49) CDC25AMAPTLMNAHTTCDC25B
SCHEMBL24327948 0.71 NSD2 (0.50) CDC25AGPR55MAPTLMNAHTT

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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