SCHEMBL9588684

SCHEMBL9588684

CON1C(C)(C)CC(OC(=O)c2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)CC1(C)C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.47
KMT2A Q03164 3/20 0.41
ALDH1A1 P00352 1/20 0.40
ESR1 P03372 1/20 0.40
HSD17B10 Q99714 1/20 0.40
SERPINE1 P05121 2/20 0.39
GAA P10253 3/20 0.37
LMNA P02545 1/20 0.37
RECQL P46063 1/20 0.37
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
MEN1 O00255 2/20 0.36
HTT P42858 2/20 0.36
ALOX5 P09917 1/20 0.35
PTGS1 P23219 1/20 0.35
PTGS2 P35354 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
GALR3 O60755 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
NPSR1 Q6W5P4 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
SCHEMBL9400310 0.90 KMT2A (0.53) TSHRKMT2AALDH1A1ESR1HSD17B10
SCHEMBL1264011 0.88 TSHR (0.64) TSHRKMT2AALDH1A1ESR1HSD17B10
SCHEMBL7511680 0.87 GAA (0.48) TSHRKMT2AALDH1A1ESR1HSD17B10
SCHEMBL9588919 0.84 TSHR (0.43) TSHRKMT2AALDH1A1ESR1HSD17B10
SCHEMBL9382414 0.82 SERPINE1 (0.41) TSHRKMT2AALDH1A1SERPINE1GAA
SCHEMBL10817965 0.82 GAA (0.58) TSHRKMT2ASERPINE1GAALMNA
SCHEMBL11271389 0.81 TSHR (0.39) TSHRKMT2ASERPINE1GAALMNA
SCHEMBL9765824 0.81 GAA (0.43) TSHRKMT2ASERPINE1GAALMNA
SCHEMBL9591172 0.81 TSHR (0.63) TSHRKMT2AALDH1A1ESR1HSD17B10
SCHEMBL13474857 0.81 TSHR (0.54) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5204473-A O-substituted N-hydroxy hindered amine stabilizers CIBA-GEIGY CORPORATION (US) 1993-04-20 US disclosed