SCHEMBL27374653

SCHEMBL27374653

O=C(COc1ccc(Cl)cc1Cl)NOCc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.62
▸ ALDH1A1 P00352 3/20 0.62
▸ L3MBTL1 Q9Y468 2/20 0.62
▸ NPC1 O15118 3/20 0.61
▸ RAB9A P51151 3/20 0.61
▸ CYP1A2 P05177 1/20 0.58
▸ CYP3A4 P08684 1/20 0.58
▸ CYP2D6 P10635 1/20 0.58
▸ CYP2C19 P33261 1/20 0.58
▸ TDP1 Q9NUW8 3/20 0.57
▸ ADAMTS5 Q9UNA0 1/20 0.56
▸ HPGD P15428 2/20 0.56
▸ MITF O75030 1/20 0.56
▸ TP53 P04637 1/20 0.56
▸ PKM P14618 1/20 0.56
▸ XBP1 P17861 1/20 0.56
▸ TSHR P16473 1/20 0.56
▸ SMN1; SMN2 Q16637 2/20 0.55
▸ KDM4E B2RXH2 4/20 0.55
▸ MAPT P10636 2/20 0.55

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
SCHEMBL27374748 0.92 SMN1; SMN2 (0.58) LMNAALDH1A1L3MBTL1NPC1RAB9A
SCHEMBL27374753 0.88 LMNA (0.66) LMNAALDH1A1L3MBTL1NPC1RAB9A
SCHEMBL27374818 0.85 MEN1 (0.63) LMNAALDH1A1RAB9ATDP1HPGD
SCHEMBL27374651 0.82 TDP1 (0.60) LMNAALDH1A1L3MBTL1NPC1RAB9A
SCHEMBL27374983 0.80 TDP1 (0.61) LMNAALDH1A1L3MBTL1NPC1RAB9A
SCHEMBL27374750 0.80 MEN1 (0.50) LMNAALDH1A1L3MBTL1NPC1RAB9A
SCHEMBL27374730 0.79 TDP1 (0.67) LMNAALDH1A1L3MBTL1NPC1RAB9A
SCHEMBL27374817 0.78 SMN1; SMN2 (0.68) LMNAALDH1A1L3MBTL1NPC1RAB9A
SCHEMBL27374904 0.78 ALDH1A1 (0.60) LMNAALDH1A1NPC1RAB9ATDP1
SCHEMBL27374823 0.78 SMN1; SMN2 (0.67) LMNAALDH1A1L3MBTL1NPC1RAB9A

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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