SCHEMBL11145285

SCHEMBL11145285

CC(NCCCO)S(=O)(=O)O

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 3/20 0.37
PTGS1 P23219 1/20 0.32
KCNH2 Q12809 1/20 0.32
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL2869288 0.88 GRIA1 (0.33) GRIA1ALDH1A1HSD17B10
SCHEMBL11667830 0.84 TP53 (0.45) ALDH1A1
SCHEMBL10807218 0.84 CA2 (0.43) GRIA1
SCHEMBL28387464 0.83 GRIA1 (0.36) GRIA1
SCHEMBL1207307 0.83 APP (0.38) GRIA1LMNAHSD17B10
SCHEMBL5007363 0.83 CA2 (0.47) GRIA1
SCHEMBL15774303 0.83 CA2 (0.47) GRIA1
SCHEMBL7104113 0.83 CA2 (0.47) GRIA1
SCHEMBL29178058 0.81 CA2 (0.46) GRIA1
SCHEMBL23926322 0.79 MEN1 (0.34) GRIA1LMNA

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-4368287-A POLYESTER CONTAINING AMINO-SULFONIC AMPHOIONIC GROUP NIPPON PAINT CO., LTD. (JP) 1983-01-11 US disclosed
US-4328143-A Aqueous coating composition NIPPON PAINT COMPANY, LTD. (JP) 1982-05-04 US disclosed
US-4322324-A Ampho-ionic group-containing alkyd resins NIPPON PAINT CO., LTD. (JP) 1982-03-30 US disclosed