SCHEMBL28465674

SCHEMBL28465674

CCCCCCCCCCCCCCCC[O-].CCCCCCCCCCCCCCCC[O-].CCCCCCCCCCCCCCCC[O-].[Al+3]

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.57
THRB P10828 1/20 0.57
CES2 O00748 3/20 0.43
CES1 P23141 3/20 0.43
DNM1 Q05193 5/20 0.42
ALDH1A1 P00352 3/20 0.42
LMNA P02545 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
HSD17B10 Q99714 1/20 0.42
SLC22A1 O15245 1/20 0.42

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
SCHEMBL3066829 1.00 TSHR (0.57) TSHRTHRBCES2CES1DNM1
SCHEMBL28654453 1.00 TSHR (0.57) TSHRTHRBCES2CES1DNM1
SCHEMBL2919820 1.00 TSHR (0.57) TSHRTHRBCES2CES1DNM1
SCHEMBL18429969 1.00 TSHR (0.57) TSHRTHRBCES2CES1DNM1
SCHEMBL1487586 1.00 TSHR (0.57) TSHRTHRBCES2CES1DNM1
SCHEMBL38662306 0.96 TSHR (0.50) TSHRTHRBCES2CES1DNM1
Lithium Ion SCHEMBL15135032 0.93 TSHR (0.57) TSHRTHRBCES2CES1DNM1
Lithium Ion SCHEMBL939261 0.93
Lithium Ion SCHEMBL10406853 0.93 TSHR (0.57) TSHRTHRBCES2CES1DNM1
Potassium Ion SCHEMBL7738513 0.93

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
CN-111636921-B Method for storing crude oil by using low-permeability and ultra-low-permeability stratum 中国石油大学(华东) 2022-04-05 CN claimed
CN-111636921-A Method for storing crude oil by using low-permeability and ultra-low-permeability stratum 中国石油大学(华东) 2020-09-08 CN claimed
CN-111636921-B Method for storing crude oil by using low-permeability and ultra-low-permeability stratum 中国石油大学(华东) 2022-04-05 CN disclosed
CN-111636921-A Method for storing crude oil by using low-permeability and ultra-low-permeability stratum 中国石油大学(华东) 2020-09-08 CN disclosed