SCHEMBL27374457

SCHEMBL27374457

O=C(COc1ccc(Cl)cc1Cl)O/N=C/c1ccc(/C=N/OC(=O)COc2ccc(Cl)cc2Cl)cc1

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 4/20 0.56
▸ MAPT P10636 4/20 0.55
▸ LMNA P02545 3/20 0.55
▸ NPC1 O15118 2/20 0.55
▸ RAB9A P51151 2/20 0.55
▸ GAA P10253 2/20 0.53
▸ NFKB1 P19838 1/20 0.53
▸ NFKB2 Q00653 1/20 0.53
▸ RELA Q04206 1/20 0.53
▸ ALDH1A1 P00352 1/20 0.52
▸ L3MBTL1 Q9Y468 1/20 0.52
▸ MAPK1 P28482 1/20 0.52
▸ TSHR P16473 2/20 0.51
▸ HTT P42858 1/20 0.51
▸ SMN1; SMN2 Q16637 3/20 0.51
▸ HPGD P15428 2/20 0.51
▸ ALOX12 P18054 1/20 0.50
▸ NPSR1 Q6W5P4 1/20 0.50
▸ POLB P06746 1/20 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
SCHEMBL30750926 1.00 TDP1 (0.56) TDP1MAPTLMNANPC1RAB9A
SCHEMBL27374346 0.99 TDP1 (0.55) TDP1MAPTLMNANPC1RAB9A
SCHEMBL27374016 0.94 TDP1 (0.56) TDP1MAPTLMNANPC1RAB9A
SCHEMBL27374339 0.92 MAPT (0.59) TDP1MAPTLMNANPC1RAB9A
SCHEMBL27374275 0.91 NPC1 (0.65) TDP1MAPTLMNANPC1RAB9A
SCHEMBL27374272 0.85 HPGD (0.64) TDP1MAPTLMNANPC1RAB9A
SCHEMBL27374341 0.82 NPC1 (0.63) TDP1MAPTLMNANPC1RAB9A
SCHEMBL27374355 0.82 MAPT (0.59) TDP1MAPTLMNANPC1RAB9A
SCHEMBL10824041 0.80 PTGS2 (0.58) TDP1MAPTLMNANPC1RAB9A
SCHEMBL27374100 0.77 NPC1 (0.66) TDP1MAPTLMNANPC1RAB9A

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-2024031002-A1 (2,4-DICHLOROPHENOXY)ACETIC ACID ANALOGS CORTEVA AGRISCIENCE LLC (US) 2024-02-08 — — WO disclosed
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