SCHEMBL9440221

SCHEMBL9440221

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

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.40
KMT2A Q03164 2/20 0.35
ALDH1A1 P00352 1/20 0.33
ESR1 P03372 1/20 0.33
HSD17B10 Q99714 1/20 0.33
MEN1 O00255 1/20 0.33
GAA P10253 1/20 0.33

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
SCHEMBL9400312 0.95 TSHR (0.37) TSHRKMT2AALDH1A1ESR1HSD17B10
SCHEMBL7478446 0.80 NAAA (0.31)
SCHEMBL14224276 0.79 SRD5A1 (0.34) TSHR
SCHEMBL1138443 0.79 SRD5A1 (0.34)
SCHEMBL16341866 0.77 TSHR (0.48) TSHRKMT2AALDH1A1ESR1HSD17B10
SCHEMBL7476545 0.73 ALOX15 (0.35) GAA
SCHEMBL308455 0.73 SRD5A1 (0.38) ALDH1A1GAA
SCHEMBL12862666 0.70 TSHR (0.38) TSHRKMT2AALDH1A1ESR1HSD17B10
SCHEMBL13110304 0.70 TSHR (0.50) TSHRKMT2AALDH1A1ESR1HSD17B10
SCHEMBL7514929 0.70 TSHR (0.50) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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