SCHEMBL6916875

SCHEMBL6916875

O=C(O)C1(Br)CCCCC1Br.[Cd]

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.30

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
SCHEMBL11757885 0.98 CYP2C19 (0.31) CYP2C19
SCHEMBL6914802 0.96 CYP2C19 (0.30) CYP2C19
SCHEMBL6916805 0.96 CYP2C19 (0.30) CYP2C19
SCHEMBL6914810 0.96 CYP2C19 (0.30) CYP2C19
SCHEMBL6914218 0.96 CYP2C19 (0.30) CYP2C19
SCHEMBL6912647 0.96 CYP2C19 (0.30) CYP2C19
SCHEMBL6909790 0.96 CYP2C19 (0.30) CYP2C19
SCHEMBL6914805 0.96 CYP2C19 (0.30) CYP2C19
SCHEMBL6914224 0.77
SCHEMBL9305517 0.77 GRM4 (0.34) CYP2C19

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6830704-B2 Contains a Lewis acid metal salt and a compound having clathrating ability. TOAGOSEI CO., LTD. (JP) 2004-12-14 US disclosed
US-20030135016-A1 Contains a Lewis acid metal salt and a compound having clathrating ability. TOAGOSEI CO., LTD. 2003-07-17 US disclosed
US-6547985-B1 Adhesive mixture TOGOSEI CO., LTD. (JP) 2003-04-15 US disclosed