SCHEMBL9400301

SCHEMBL9400301

C=CC(=O)OC1CC(C)(C)N(OC(C)=O)C(C)(C)C1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.55
KMT2A Q03164 2/20 0.48
ALDH1A1 P00352 1/20 0.46
ESR1 P03372 1/20 0.46
HSD17B10 Q99714 1/20 0.46
GAA P10253 2/20 0.39
MEN1 O00255 1/20 0.39
HTT P42858 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
SCHEMBL25701767 0.90 TSHR (0.43) TSHRKMT2AALDH1A1ESR1HSD17B10
SCHEMBL7795589 0.86 ALDH1A1 (0.42) TSHRKMT2AALDH1A1ESR1HSD17B10
SCHEMBL9350754 0.84 TSHR (0.38) TSHRKMT2AALDH1A1ESR1HSD17B10
SCHEMBL1138567 0.83 KMT2A (0.63) TSHRKMT2AALDH1A1ESR1HSD17B10
SCHEMBL12921994 0.82 TSHR (0.61) TSHRKMT2AALDH1A1ESR1HSD17B10
SCHEMBL9576921 0.81 TSHR (0.35) TSHRKMT2AALDH1A1ESR1HSD17B10
SCHEMBL1053833 0.80 GAA (0.44) TSHRKMT2AALDH1A1ESR1HSD17B10
SCHEMBL3191892 0.80 TSHR (0.33) TSHRKMT2AALDH1A1ESR1HSD17B10
SCHEMBL69507 0.80 TSHR (0.33) TSHRKMT2AALDH1A1ESR1HSD17B10
SCHEMBL25701766 0.79 TSHR (0.35) TSHRKMT2AALDH1A1ESR1HSD17B10

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-5300647-A Light stabilizers for polyolefins, other polymers CIBA-GEIGY CORPORATION (US) 1994-04-05 US claimed
US-5300647-A Light stabilizers for polyolefins, other polymers CIBA-GEIGY CORPORATION (US) 1994-04-05 US disclosed
EP-0309400-B1 N-acyloxy hindered amine stabilizers CIBA GEIGY AG (CH) 1994-03-02 EP disclosed
EP-0309400-A2 N-acyloxy hindered amine stabilizers CIBA-GEIGY AG (CH) 1989-03-29 EP disclosed