SCHEMBL5888768

SCHEMBL5888768

CN[C@H]1CCC[C@@H]1N1CCCC1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CHRNB4 P30926 1/20 0.37
▸ CHRNA3 P32297 1/20 0.37
▸ SIGMAR1 Q99720 4/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ CHRNA7 P36544 1/20 0.36
▸ CYP2D6 P10635 3/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ MCOLN2 Q8IZK6 1/20 0.35
▸ MCOLN1 Q9GZU1 1/20 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
SCHEMBL13463493 1.00 CHRNB4 (0.37) CHRNB4CHRNA3SIGMAR1TDP1CHRNA7
SCHEMBL11482461 0.98 CHRNA7 (0.38) CHRNB4CHRNA3SIGMAR1TDP1CHRNA7
SCHEMBL11482467 0.98 CHRNA7 (0.38) CHRNB4CHRNA3SIGMAR1TDP1CHRNA7
SCHEMBL8762939 0.95 TDP1 (0.41) CHRNB4CHRNA3SIGMAR1TDP1CHRNA7
SCHEMBL7343637 0.95 TDP1 (0.41) CHRNB4CHRNA3SIGMAR1TDP1CHRNA7
SCHEMBL2441202 0.95 TDP1 (0.41) CHRNB4CHRNA3SIGMAR1TDP1CHRNA7
SCHEMBL2441220 0.95 TDP1 (0.41) CHRNB4CHRNA3SIGMAR1TDP1CHRNA7
SCHEMBL10366437 0.93 CHRNA7 (0.41) CHRNB4CHRNA3SIGMAR1TDP1CHRNA7
SCHEMBL10366436 0.93 CHRNA7 (0.41) CHRNB4CHRNA3SIGMAR1TDP1CHRNA7
SCHEMBL8761967 0.93 CHRNA7 (0.41) CHRNB4CHRNA3SIGMAR1TDP1CHRNA7

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-7053087-B1 Aminocycloalkyl cinnamide compounds for arrhythmia and analgesics and anesthetics CARDIOME PHARMA CORP. (CA) 2006-05-30 — — US disclosed
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