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SCHEMBL9738855

SCHEMBL9738855

CC(=O)ON1C(C)(C)CC(OC(=O)C(CCCCCCCC(=O)O)C2CC(C)(C)N(OC(C)=O)C(C)(C)C2)CC1(C)C

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 2/20 0.45
▸ KMT2A Q03164 2/20 0.40
▸ MEN1 O00255 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ ALDH1A1 P00352 2/20 0.36
▸ ESR1 P03372 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ FFAR4 Q5NUL3 1/20 0.30
▸ FFAR1 O14842 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
SCHEMBL1138879 0.88 TSHR (0.33) TSHRKMT2AMEN1GAAALDH1A1
SCHEMBL28432420 0.86 ALDH1A1 (0.35) TSHRGAAALDH1A1HSD17B10FFAR4
SCHEMBL207971 0.86 FFAR4 (0.35) TSHRALDH1A1HSD17B10FFAR4FFAR1
SCHEMBL15387457 0.85 ALDH1A1 (0.34) ALDH1A1FFAR4FFAR1
SCHEMBL6397244 0.84 TSHR (0.35) TSHRALDH1A1HSD17B10FFAR4
SCHEMBL7473310 0.84 TSHR (0.35) TSHRALDH1A1HSD17B10FFAR4
SCHEMBL7483643 0.84 TSHR (0.35) TSHRALDH1A1HSD17B10FFAR4
SCHEMBL454162 0.83 — —
SCHEMBL226381 0.83 FFAR4 (0.38) TSHRKMT2AMEN1ALDH1A1ESR1
SCHEMBL9744169 0.83 FFAR4 (0.38) TSHRKMT2AMEN1ALDH1A1ESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5124378-A Resin containign N-Hydroxyl hindered amine oxidative and light stabilizers CIBA-GEIGY CORPORATION (US) 1992-06-23 — — US claimed