SCHEMBL23912207

SCHEMBL23912207

CCCCCP1(=O)OP(=O)(CCCCC)OP(=O)(CCCCCCCCCP2(=O)OP(=O)(CCCC)OP(=O)(CCCC)O2)O1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.40
THRB P10828 1/20 0.40
CES2 O00748 3/20 0.33
CES1 P23141 3/20 0.33
EPHX2 P34913 1/20 0.33
HSP90AA1 P07900 1/20 0.33
GPR84 Q9NQS5 6/20 0.32
PPARG P37231 6/20 0.32
PPARD Q03181 6/20 0.32
PPARA Q07869 6/20 0.32
HDAC11 Q96DB2 5/20 0.32
ALDH1A1 P00352 2/20 0.32
TLR2 O60603 2/20 0.32
TDP1 Q9NUW8 2/20 0.32
FABP4 P15090 2/20 0.32
PTPN1 P18031 2/20 0.32
SLC22A6 Q4U2R8 1/20 0.32
SLC22A8 Q8TCC7 1/20 0.32
MEN1 O00255 1/20 0.32
ESR1 P03372 1/20 0.32

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
SCHEMBL3732698 0.97 TSHR (0.42) TSHRTHRBCES2CES1EPHX2
SCHEMBL11424216 0.76 TSHR (0.36) TSHRTHRBCES2CES1EPHX2
SCHEMBL8200500 0.76 TSHR (0.36) TSHRTHRBCES2CES1EPHX2
SCHEMBL5553619 0.75 TSHR (0.35) TSHRTHRBCES2CES1EPHX2
SCHEMBL24203397 0.69
Tetradecane SCHEMBL23924271 0.63 TSHR (1.00) TSHRTHRBALDH1A1MEN1KMT2A
Tetradecane SCHEMBL25387874 0.63 TSHR (1.00) TSHRTHRBALDH1A1MEN1KMT2A
SCHEMBL23854647 0.63 TSHR (1.00) TSHRTHRBALDH1A1MEN1KMT2A
Undecane SCHEMBL20767628 0.63 TSHR (1.00) TSHRTHRBALDH1A1MEN1KMT2A
Nonane SCHEMBL8821202 0.63 TSHR (1.00) TSHRTHRBALDH1A1MEN1KMT2A

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-4020651-A1 ELECTROCHEMICAL DEVICE AND ELECTRONIC DEVICE COMPRISING SAME Ningde Amperex Technology Limited (CN) 2022-06-29 EP disclosed
EP-3627606-B1 ELECTROLYTE AND ELECTROCHEMICAL DEVICE NINGDE AMPEREX TECHNOLOGY LTD (CN) 2021-10-13 EP disclosed