SCHEMBL14436795

SCHEMBL14436795

CC(=O)ON1C(C)(C)CC(C)(C)CC1(C)C

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.41
KMT2A Q03164 1/20 0.35
ALDH1A1 P00352 1/20 0.33
ESR1 P03372 1/20 0.33
HSD17B10 Q99714 1/20 0.33
GAA P10253 1/20 0.31

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
SCHEMBL15259088 0.83 TSHR (0.40) TSHRKMT2AALDH1A1ESR1HSD17B10
SCHEMBL9739494 0.81 TSHR (0.39) TSHRKMT2AALDH1A1ESR1HSD17B10
SCHEMBL1138731 0.81 TSHR (0.36) TSHRKMT2A
SCHEMBL986872 0.77 TSHR (0.41) TSHRKMT2AALDH1A1ESR1HSD17B10
SCHEMBL14448423 0.77 TSHR (0.36) TSHRKMT2A
Ammonia Solution, Strong SCHEMBL9791511 0.76 TSHR (0.41) TSHRKMT2AALDH1A1ESR1HSD17B10
SCHEMBL13110304 0.74 TSHR (0.50) TSHRKMT2AALDH1A1ESR1HSD17B10
SCHEMBL7514929 0.74 TSHR (0.50) TSHRKMT2AALDH1A1ESR1HSD17B10
SCHEMBL4325339 0.71 TSHR (0.55) TSHRKMT2AALDH1A1ESR1HSD17B10
SCHEMBL987544 0.71 TSHR (0.55) 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
US-20130245203-A1 Viscosity Breaking Process for Olefin Polymers BASF SE (DE) 2013-09-19 US disclosed
US-20070200272-A1 Viscosity breaking process for olefin polymers CIBA SPECIALTY CHEMICALS CORP. 2007-08-30 US disclosed