SCHEMBL8464553

SCHEMBL8464553

O=C(O)c1c(Cl)c(Cl)c(C(=O)O)c(I(=O)=O)c1Cl

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 1/20 0.32
▸ DPP4 P27487 1/20 0.32

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
SCHEMBL8464777 0.93 HTT (0.32) HTTDPP4
SCHEMBL4899263 0.79 DPP4 (0.43) HTTDPP4
SCHEMBL70425 0.79 DPP4 (0.43) HTTDPP4
Hydrochloric Acid SCHEMBL2393100 0.76 DPP4 (0.42) HTTDPP4
SCHEMBL205832 0.76 HTT (0.45) HTTDPP4
Hydrochloric Acid SCHEMBL11671966 0.76 DPP4 (0.42) HTTDPP4
SCHEMBL8459525 0.74 DPP4 (0.36) DPP4
SCHEMBL1303087 0.73 HTT (0.43) HTTDPP4
SCHEMBL5406015 0.73 HTT (0.43) HTTDPP4
SCHEMBL6903601 0.73 HTT (0.48) HTTDPP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0745326-B1 Stabilization of aqueous 3-isothiazolone solutions ROHM & HAAS (US) 1999-09-22 — — EP disclosed
US-5594017-A WITH AN IODOSYL OR IODYL COMPOUND ROHM AND HAAS COMPANY (US) 1997-01-14 — — US disclosed
EP-0745326-A1 Stabilization of aqueous 3-isothiazolone solutions ROHM AND HAAS COMPANY (US) 1996-12-04 — — EP disclosed
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