SCHEMBL9207630

SCHEMBL9207630

CCCC(CO)(CO)CS

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.30
TSHR P16473 2/20 0.30

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
SCHEMBL9261259 0.94 ALDH1A1 (0.30) ALDH1A1TSHR
SCHEMBL9788140 0.84 ALDH1A1 (0.35) ALDH1A1TSHR
SCHEMBL4530110 0.82 TSHR (0.37) ALDH1A1TSHR
SCHEMBL1053504 0.82 TSHR (0.37) ALDH1A1TSHR
SCHEMBL9256142 0.82
SCHEMBL39090 0.82 TSHR (0.37) ALDH1A1TSHR
SCHEMBL8991763 0.82
SCHEMBL9252994 0.79 ALDH1A1 (0.35) ALDH1A1TSHR
SCHEMBL6742595 0.77 ALDH1A1 (0.33) ALDH1A1TSHR
SCHEMBL7635873 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0216624-B1 Pesticidal compounds ROUSSEL UCLAF (FR) 1995-02-22 EP disclosed
US-5371075-A Pesticides ROUSSEL-UCLAF (FR) 1994-12-06 US disclosed
US-5157029-A Insecticides, miticides THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1992-10-20 US disclosed
US-5057508-A Bicyclo(2-2-1)octanes THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1991-10-15 US disclosed
US-4985582-A CHEMICAL INTERMEDIATES FOR BICYCLIC RING COMPOUNDS HAVING MULTIPLE SULFUR ATOMS IN THE RING SYSTEM THE WELLCOME FOUNDATION LTD. (GB) 1991-01-15 US disclosed
US-4965257-A INSECTICIDES, ACARICIDES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1990-10-23 US disclosed
EP-0216624-A2 Pesticidal compounds ROUSSEL-UCLAF (FR) 1987-04-01 EP disclosed