SCHEMBL13760464

SCHEMBL13760464

CCC1(CC)CC(OC(C)=O)CC(C)(C)N1OC=O

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.45
KMT2A Q03164 2/20 0.45
ALDH1A1 P00352 1/20 0.43
ESR1 P03372 1/20 0.43
HSD17B10 Q99714 1/20 0.43
MEN1 O00255 1/20 0.39
GAA P10253 1/20 0.39

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
SCHEMBL1139067 0.85 TSHR (0.50) TSHRKMT2AALDH1A1ESR1HSD17B10
SCHEMBL24833770 0.78 KMT2A (0.42) TSHRKMT2AALDH1A1ESR1HSD17B10
SCHEMBL13110325 0.76 TSHR (0.47) TSHRKMT2AALDH1A1ESR1HSD17B10
SCHEMBL20073661 0.75 TSHR (0.51) TSHRKMT2AALDH1A1ESR1HSD17B10
SCHEMBL6404112 0.75 KMT2A (0.37) TSHRKMT2AALDH1A1ESR1HSD17B10
SCHEMBL15987036 0.75 KMT2A (0.54) TSHRKMT2AALDH1A1ESR1HSD17B10
SCHEMBL13071709 0.74 TSHR (0.53) TSHRKMT2AALDH1A1ESR1HSD17B10
SCHEMBL5342996 0.73 KMT2A (0.53) TSHRKMT2AALDH1A1ESR1HSD17B10
SCHEMBL5573455 0.73 KMT2A (0.55) TSHRKMT2AALDH1A1ESR1HSD17B10
SCHEMBL1138567 0.73 KMT2A (0.63) 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
EP-1440115-B1 CROSSLINKING OF UNSATURATED POLYESTERS BY THE USE OF HYDROXYLAMINE-ESTERS CIBA HOLDING INC (CH) 2009-08-05 EP disclosed