SCHEMBL2941887

SCHEMBL2941887

CC(C)COCCOCCC(=O)O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRP O00591 2/20 0.37
GABRD O14764 2/20 0.37
GABRA1 P14867 2/20 0.37
GABRB1 P18505 2/20 0.37
GABRG2 P18507 2/20 0.37
GABRB3 P28472 2/20 0.37
GABRA5 P31644 2/20 0.37
GABRA3 P34903 2/20 0.37
GABRA2 P47869 2/20 0.37
GABRB2 P47870 2/20 0.37
GABRA4 P48169 2/20 0.37
GABRE P78334 2/20 0.37
GABRA6 Q16445 2/20 0.37
GABRG1 Q8N1C3 2/20 0.37
GABRG3 Q99928 2/20 0.37
GABRQ Q9UN88 2/20 0.37
CYP1A2 P05177 1/20 0.37
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
LMNA P02545 3/20 0.35

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
SCHEMBL2950666 1.00 GABRP (0.37) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL2941882 1.00 GABRP (0.37) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL1774798 0.96 GABRP (0.39) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL17908953 0.88 TSHR (0.46) MEN1KMT2ALMNAPLA2G2CHSD17B10
SCHEMBL17909259 0.88 TSHR (0.46) MEN1KMT2ALMNAPLA2G2CHSD17B10
SCHEMBL17909058 0.88 TSHR (0.46) MEN1KMT2ALMNAPLA2G2CHSD17B10
Triethylene Glycol SCHEMBL2963192 0.86 MEN1 (0.42) GABRPGABRDGABRA1GABRB1GABRG2
Succinic Acid SCHEMBL2958155 0.86 MEN1 (0.42) GABRPGABRDGABRA1GABRB1GABRG2
Adipic Acid SCHEMBL2952891 0.83 GPR84 (0.42) MEN1KMT2ALMNAHSD17B10PMP22
Adipic Acid SCHEMBL2960080 0.83 GPR84 (0.42) MEN1KMT2ALMNAHSD17B10PMP22

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
EP-1886759-B1 WATER-SOLUBLE PREFLUX AND USE THEREOF SHIKOKU CHEM (JP) 2016-10-05 EP disclosed
US-7754105-B2 Water-soluble preflux and usage of the same SHIKOKU CHEMICALS CORPORATION (JP) 2010-07-13 US disclosed
US-20080318070-A1 Water-Soluble Preflux and Usage of the Same SHIKOKU CHEMICALS CORPORATION (JP) 2008-12-25 US disclosed
EP-1886759-A1 WATER-SOLUBLE PREFLUX AND USE THEREOF SHIKOKU CHEMICALS CORPORATION (JP) 2008-02-13 EP disclosed