SCHEMBL10846830

SCHEMBL10846830

COS(=O)(=O)Cc1cccc2c1CCc1ccsc1-2

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.31

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
SCHEMBL10846949 0.93 BRD4 (0.32)
SCHEMBL10846409 0.75 PDCD1 (0.34) ALDH1A1GAA
SCHEMBL10846040 0.68 BCHE (0.37) ALDH1A1
SCHEMBL10846178 0.68 NOTUM (0.43) ALDH1A1
SCHEMBL10844643 0.67 NOS3 (0.32) ALDH1A1
SCHEMBL10846054 0.67 CHRNE (0.34) ALDH1A1
SCHEMBL10845839 0.66 NOTUM (0.53)
SCHEMBL10855876 0.64 NOTUM (0.33) ALDH1A1
SCHEMBL5109816 0.63 CES1 (0.46) ALDH1A1GAA
SCHEMBL14128140 0.63 NOTUM (0.39) ALDH1A1GAA

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
US-4605748-A INSECTICIDES, MITICIDES FMC CORPORATION (US) 1986-08-12 US claimed
US-4605748-A INSECTICIDES, MITICIDES FMC CORPORATION (US) 1986-08-12 US disclosed
US-4487778-A Insecticidal esters derived from benzocycloalkane-thiophenemethyl compounds FMC CORPORATION (US) 1984-12-11 US disclosed