SCHEMBL27374275

SCHEMBL27374275

O=C(COc1ccc(Cl)cc1Cl)O/N=C/c1ccncc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 5/20 0.65
▸ RAB9A P51151 5/20 0.65
▸ MAPT P10636 4/20 0.65
▸ LMNA P02545 4/20 0.65
▸ SMN1; SMN2 Q16637 5/20 0.54
▸ HPGD P15428 4/20 0.54
▸ GAA P10253 1/20 0.54
▸ NFKB1 P19838 1/20 0.54
▸ NFKB2 Q00653 1/20 0.54
▸ RELA Q04206 1/20 0.54
▸ ALDH1A1 P00352 4/20 0.53
▸ KDM4E B2RXH2 1/20 0.53
▸ GLA P06280 1/20 0.53
▸ MAPK1 P28482 1/20 0.53
▸ KMT2A Q03164 3/20 0.53
▸ MEN1 O00255 2/20 0.53
▸ TDP1 Q9NUW8 4/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ HTT P42858 1/20 0.46
▸ TSHR P16473 1/20 0.46

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 0.91 TDP1 (0.56) NPC1RAB9AMAPTLMNASMN1; SMN2
SCHEMBL27374457 0.91 TDP1 (0.56) NPC1RAB9AMAPTLMNASMN1; SMN2
SCHEMBL27374346 0.90 TDP1 (0.55) NPC1RAB9AMAPTLMNASMN1; SMN2
SCHEMBL27374016 0.88 TDP1 (0.56) NPC1RAB9AMAPTLMNASMN1; SMN2
SCHEMBL27374272 0.86 HPGD (0.64) NPC1RAB9AMAPTLMNASMN1; SMN2
SCHEMBL27374339 0.84 MAPT (0.59) NPC1RAB9AMAPTLMNASMN1; SMN2
SCHEMBL27374341 0.81 NPC1 (0.63) NPC1RAB9AMAPTLMNASMN1; SMN2
SCHEMBL27374265 0.78 NPC1 (0.77) NPC1RAB9AMAPTLMNASMN1; SMN2
SCHEMBL27375095 0.77 NPC1 (0.62) NPC1RAB9AMAPTLMNASMN1; SMN2
SCHEMBL27374355 0.77 MAPT (0.59) NPC1RAB9AMAPTLMNASMN1; SMN2

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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