3,6 Dichloromethoxybenzoic Acid

3,6 Dichloromethoxybenzoic Acid

SCHEMBL3266728

COc1c(Cl)ccc(Cl)c1C(=O)O.O=CO

nearest known ligand 0.86

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Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.86
▸ KDM4E B2RXH2 1/20 0.86
▸ HSD17B10 Q99714 1/20 0.86
▸ TSHR P16473 1/20 0.55
▸ TAS1R3 Q7RTX0 7/20 0.47
▸ TAS1R1 Q7RTX1 7/20 0.47
▸ TAS1R2 Q8TE23 5/20 0.46
▸ DPP4 P27487 1/20 0.46
▸ TPMT P51580 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ CA12 O43570 1/20 0.40
▸ CA1 P00915 1/20 0.40
▸ CA2 P00918 1/20 0.40
▸ CA7 P43166 1/20 0.40
▸ CA9 Q16790 1/20 0.40
▸ CA14 Q9ULX7 1/20 0.40
▸ MEP1B Q16820 1/20 0.40
▸ KMO O15229 1/20 0.38

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
3,6 Dichloromethoxybenzoic Acid SCHEMBL29539000 0.93 ALDH1A1 (1.00) ALDH1A1KDM4EHSD17B10TSHRTAS1R3
3,6 Dichloromethoxybenzoic Acid SCHEMBL1932787 0.93 ALDH1A1 (1.00) ALDH1A1KDM4EHSD17B10TSHRTAS1R3
3,6 Dichloromethoxybenzoic Acid SCHEMBL18336 0.93 ALDH1A1 (1.00) ALDH1A1KDM4EHSD17B10TSHRTAS1R3
3,6 Dichloromethoxybenzoic Acid SCHEMBL1702321 0.91 ALDH1A1 (0.96) ALDH1A1KDM4EHSD17B10TSHRTAS1R3
3,6 Dichloromethoxybenzoic Acid SCHEMBL28550692 0.91 ALDH1A1 (0.96) ALDH1A1KDM4EHSD17B10TSHRTAS1R3
3,6 Dichloromethoxybenzoic Acid SCHEMBL1702325 0.91 ALDH1A1 (0.96) ALDH1A1KDM4EHSD17B10TSHRTAS1R3
3,6 Dichloromethoxybenzoic Acid SCHEMBL1682195 0.91 ALDH1A1 (0.96) ALDH1A1KDM4EHSD17B10TSHRTAS1R3
3,6 Dichloromethoxybenzoic Acid SCHEMBL10683360 0.91 ALDH1A1 (0.96) ALDH1A1KDM4EHSD17B10TSHRTAS1R3
3,6 Dichloromethoxybenzoic Acid SCHEMBL2369132 0.91 ALDH1A1 (0.96) ALDH1A1KDM4EHSD17B10TSHRTAS1R3
3,6 Dichloromethoxybenzoic Acid SCHEMBL1268564 0.91 ALDH1A1 (0.96) ALDH1A1KDM4EHSD17B10TSHRTAS1R3

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1328499-B1 METHOD OF PRODUCING CARBOXYLIC ACID SALTS BASF CORP (US) 2010-05-05 — — EP disclosed
US-6410783-B1 Method of producing carboxylic acid salts BASF CORPORATION 2002-06-25 — — US disclosed
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