SCHEMBL10728643

SCHEMBL10728643

CC(C)(C)OOOC(=O)C(=CC(=O)O)OOC(C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.34
TSHR P16473 1/20 0.34
HSD17B10 Q99714 1/20 0.34
TDP1 Q9NUW8 1/20 0.34

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
SCHEMBL11128175 0.83 ALDH1A1 (0.35) ALDH1A1TSHRHSD17B10TDP1
SCHEMBL28594953 0.82 ALDH1A1 (0.33) ALDH1A1TSHRHSD17B10TDP1
SCHEMBL1226574 0.80 HCAR2 (0.35)
SCHEMBL65754 0.80 ALDH1A1 (0.38) ALDH1A1TSHRHSD17B10TDP1
SCHEMBL210792 0.80 ALDH1A1 (0.38) ALDH1A1TSHRHSD17B10TDP1
SCHEMBL17364120 0.79 ALDH1A1 (0.32) ALDH1A1TSHRHSD17B10TDP1
SCHEMBL4732197 0.79 ALDH1A1 (0.32) ALDH1A1TSHRHSD17B10TDP1
SCHEMBL4732018 0.78 ALDH1A1 (0.31) ALDH1A1TSHRHSD17B10TDP1
SCHEMBL4732254 0.75 KDM4E (0.31) TSHR
SCHEMBL17364123 0.75 KDM4E (0.31) TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4655963-A COMPOSITE OF THERMOPLASTIC COPOLYMER CONTAINING AN UNSATURATED PEROXY COMPOUND AND CARBON BLACK; PARTICLE SIZES CENTRAL GLASS COMPANY, LIMITED (JP) 1987-04-07 US claimed
EP-0178141-B1 PEROXYCARBONATE GROUP-CONTAINING COPOLYMER AND METHOD FOR MANUFACTURE THEREOF NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1987-12-23 EP disclosed
US-4658001-A STORAGE STABLE RANDOM COPOLYMERS WITH ANOTHER UNSATURATED COMPOUND NIPPON OILS & FATS CO., LTD. (JP) 1987-04-14 US disclosed
EP-0178141-A1 Peroxycarbonate group-containing copolymer and method for manufacture thereof NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1986-04-16 EP disclosed