SCHEMBL11547685

SCHEMBL11547685

CCC(=CCC/C(=C/CBr)CC)CC

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SQLE Q14534 2/20 0.32
FNTA P49354 1/20 0.31
FNTB P49356 1/20 0.31
BACE1 P56817 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
SCHEMBL11547687 1.00 SQLE (0.32) SQLEFNTAFNTBBACE1
SCHEMBL11866888 0.85
SCHEMBL11706727 0.85 FNTA (0.38) SQLEFNTAFNTB
SCHEMBL11866879 0.85
SCHEMBL11706722 0.85 FNTA (0.38) SQLEFNTAFNTB
SCHEMBL972276 0.84
SCHEMBL11545440 0.82 KMT2A (0.43) SQLEFNTAFNTB
SCHEMBL11545443 0.82 KMT2A (0.43) SQLEFNTAFNTB
SCHEMBL11729718 0.81 FNTA (0.39) SQLEFNTAFNTB
SCHEMBL11729724 0.81 FNTA (0.39) SQLEFNTAFNTB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4137273-A INSECTICIDES, CHEMICAL INTERMEDIATES ZOECON CORPORATION (US) 1979-01-30 US disclosed
US-3957763-A PHENYL DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 1976-05-18 US disclosed