SCHEMBL9068329

SCHEMBL9068329

CC(=O)CC(=O)OCC=CS

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MGAM O43451 2/20 0.44
GAA P10253 2/20 0.44
SI P14410 2/20 0.44
MGAM2 Q2M2H8 2/20 0.44
TSHR P16473 1/20 0.30
HSD17B10 Q99714 1/20 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
SCHEMBL5227698 0.81 MGAM (0.46) MGAMGAASIMGAM2
SCHEMBL6445001 0.81 MGAM (0.46) MGAMGAASIMGAM2TSHR
SCHEMBL6444996 0.81 MGAM (0.46) MGAMGAASIMGAM2TSHR
SCHEMBL11547161 0.79 MGAM (0.44) MGAMGAASIMGAM2TSHR
SCHEMBL19896471 0.78
SCHEMBL10339197 0.78
SCHEMBL28867898 0.76 GAA (0.41) MGAMGAASIMGAM2
SCHEMBL16667687 0.76 MGAM (0.50) MGAMGAASIMGAM2TSHR
SCHEMBL7703544 0.75 MGAM (0.40) MGAMGAASIMGAM2
SCHEMBL7396674 0.75 MGAM (0.40) MGAMGAASIMGAM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5516453-A Stable ambient-curing composition ROHM AND HAAS COMPANY (US) 1996-05-14 US disclosed
EP-0367508-B1 MERCAPTOALKYL ACETOACETATES, USE THEREOF AND A PROCESS FOR THE PREPARATION OF MERCAPTOALKYL ACETOACETATES ROHM AND HAAS COMPANY (US) 1992-07-22 EP disclosed
US-4960924-A Mercaptoalkyl acetoacetates ROHM AND HAAS COMPANY (US) 1990-10-02 US disclosed
US-4960924-A Mercaptoalkyl acetoacetates ROHM AND HAAS COMPANY (US) 1990-10-02 US disclosed
US-4960924-A Mercaptoalkyl acetoacetates ROHM AND HAAS COMPANY (US) 1990-10-02 US disclosed
EP-0367508-A1 Mercaptoalkyl acetoacetates, use thereof and a process for the preparation of mercaptoalkyl acetoacetates ROHM AND HAAS COMPANY (US) 1990-05-09 EP disclosed
EP-0367508-A1 Mercaptoalkyl acetoacetates, use thereof and a process for the preparation of mercaptoalkyl acetoacetates ROHM AND HAAS COMPANY (US) 1990-05-09 EP disclosed
EP-0367508-A1 Mercaptoalkyl acetoacetates, use thereof and a process for the preparation of mercaptoalkyl acetoacetates ROHM AND HAAS COMPANY (US) 1990-05-09 EP disclosed