SCHEMBL7865540

SCHEMBL7865540

CCCC[PH](CCCC)(CCCC)C1CCCCC1.OB(O)Oc1cccc2ccc3cc4ccccc4cc3c12

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BCHE P06276 5/20 0.31
KCNH2 Q12809 1/20 0.31
CNR2 P34972 2/20 0.31
ACHE P22303 1/20 0.31

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
SCHEMBL7877274 0.90 EPHX1 (0.31)
SCHEMBL7872954 0.84 RAB9A (0.31)
SCHEMBL995087 0.84 KCNH2 (0.33) KCNH2CNR2ACHE
SCHEMBL7874535 0.84 MEN1 (0.32) ACHE
SCHEMBL6131094 0.83 KCNH2 (0.33) KCNH2CNR2ACHE
SCHEMBL7871279 0.81 KCNH2 (0.31) KCNH2CNR2
SCHEMBL7639415 0.81
SCHEMBL7639889 0.81 KCNH2 (0.31) KCNH2CNR2
SCHEMBL7639445 0.79
SCHEMBL7874385 0.79 KCNH2 (0.31) 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
US-6316575-B1 MELT TRANSESTERIFICATION OF DIOL COMPOUND AND CARBOANTE COMPOUND USING CATALYST COMPRISING A PHOSPHORUS-CONTAINING BASIC COMPOUND QUATERNARY PHOSPHONIUM SALT TO FORM POLYCARBONATE IDEMITSU KOSAN CO., LTD. (JP) 2001-11-13 US claimed