SCHEMBL8846785

SCHEMBL8846785

CCCCCCCCCCCCOC(=O)C=CC(=O)[O-].CCCCCCCCCCCCOC(=O)C=CC(=O)[O-].[Sr+2]

nearest known ligand 0.69

Known targets — ChEMBL curated mechanism

ATP4AATP4B

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 4/20 0.69
ATM Q13315 1/20 0.66
MAPT P10636 1/20 0.50
RAB9A P51151 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
NAAA Q02083 1/20 0.48
APP P05067 4/20 0.48
TSHR P16473 3/20 0.47
HPGD P15428 1/20 0.47
HTT P42858 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
EPHX1 P07099 1/20 0.46
PRKCA P17252 1/20 0.44

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
SCHEMBL8846775 1.00 HCAR2 (0.69) HCAR2ATMMAPTRAB9ANPSR1
Zinc Ion SCHEMBL9548423 0.96 HCAR2 (0.69) HCAR2ATMMAPTRAB9ANPSR1
Stearyl Fumaric Acid SCHEMBL25396 0.96 HCAR2 (0.69) HCAR2ATMMAPTRAB9ANPSR1
SCHEMBL8846972 0.96 HCAR2 (0.69) HCAR2ATMMAPTRAB9ANPSR1
SCHEMBL8846477 0.96 HCAR2 (0.69) HCAR2ATMMAPTRAB9ANPSR1
SCHEMBL8846570 0.96 HCAR2 (0.69) HCAR2ATMMAPTRAB9ANPSR1
SCHEMBL10732344 0.96 HCAR2 (0.69) HCAR2ATMMAPTRAB9ANPSR1
Stearyl Fumaric Acid SCHEMBL2431940 0.96 HCAR2 (0.69) HCAR2ATMMAPTRAB9ANPSR1
SCHEMBL9679071 0.96 HCAR2 (0.69) HCAR2ATMMAPTRAB9ANPSR1
SCHEMBL11799659 0.96 HCAR2 (0.69) HCAR2ATMMAPTRAB9ANPSR1

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-0751177-A2 Stabilizers for high nitrile multipolymers THE STANDARD OIL COMPANY (US) 1997-01-02 EP claimed