SCHEMBL27374460

SCHEMBL27374460

O=CC(CONC(=O)c1ccc(C(=O)NOC(=O)COc2ccc(Cl)cc2Cl)cc1)Oc1ccc(Cl)cc1Cl

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 3/20 0.43
▸ SMN1; SMN2 Q16637 3/20 0.42
▸ TSHR P16473 1/20 0.42
▸ MAPT P10636 3/20 0.42
▸ LMNA P02545 2/20 0.41
▸ NPC1 O15118 2/20 0.41
▸ RAB9A P51151 2/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ KMT2A Q03164 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ RECQL P46063 1/20 0.40

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
SCHEMBL27375825 0.85 TDP1 (0.57) TDP1SMN1; SMN2TSHRMAPTLMNA
SCHEMBL27374270 0.84 TDP1 (0.56) TDP1SMN1; SMN2TSHRMAPTLMNA
SCHEMBL27374443 0.79 TDP1 (0.57) TDP1SMN1; SMN2TSHRMAPTLMNA
SCHEMBL27374367 0.74 TDP1 (0.61) TDP1SMN1; SMN2TSHRMAPTLMNA
SCHEMBL27374181 0.72 HPGD (0.69) SMN1; SMN2MAPTLMNANPC1RAB9A
SCHEMBL22592011 0.69 SMN1; SMN2 (0.47) TDP1SMN1; SMN2TSHRMAPTLMNA
SCHEMBL28644024 0.67 TDP1 (0.68) TDP1SMN1; SMN2TSHRMAPTLMNA
2,4-Dichlorophenoxyacetic Acid, Methyl Ester SCHEMBL5004223 0.67 MAPT (0.70) TDP1SMN1; SMN2TSHRMAPTLMNA
SCHEMBL6202463 0.67 TDP1 (0.68) TDP1SMN1; SMN2TSHRMAPTNPC1
SCHEMBL27374823 0.67 SMN1; SMN2 (0.67) TDP1SMN1; SMN2TSHRMAPTLMNA

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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