SCHEMBL20135795

SCHEMBL20135795

CC(C)(C)P(Cc1cccc(P(C(C)(C)C)C(C)(C)C)n1)C(C)(C)C

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 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
SCHEMBL1467841 0.85 KCNH2 (0.38) KCNH2
SCHEMBL29519505 0.83 KCNH2 (0.36) KCNH2
SCHEMBL17425884 0.79 CCR1 (0.37) KCNH2
SCHEMBL2855947 0.78
SCHEMBL21357624 0.78 KCNH2 (0.37) KCNH2
Silver SCHEMBL31742973 0.76 KCNH2 (0.32) KCNH2
SCHEMBL17559268 0.76 KCNH2 (0.32) KCNH2
SCHEMBL19418931 0.76 KCNH2 (0.32) KCNH2
SCHEMBL15850947 0.75 KCNH2 (0.35) KCNH2
SCHEMBL19418930 0.74 NPSR1 (0.40) KCNH2

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-3319951-A1 METHOD FOR THE HYDROFORMYLATION OF 2-SUBSTITUTED BUTADIENES AND THE PRODUCTION OF SECONDARY PRODUCTS THEREOF, ESPECIALLY AMBROX BASF SE (DE) 2018-05-16 EP disclosed