SCHEMBL10992013

SCHEMBL10992013

CCCC1CCC2CCCN12

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 4/20 0.39
CHRNA7 P36544 4/20 0.39
CHRNA4 P43681 4/20 0.39
LMNA P02545 1/20 0.32
DPP4 P27487 1/20 0.30
CHRNB4 P30926 1/20 0.30
CHRNA3 P32297 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
SCHEMBL21134659 0.94 CHRNB2 (0.37) CHRNB2CHRNA7CHRNA4
SCHEMBL19628592 0.92 CHRNB2 (0.36) CHRNB2CHRNA7CHRNA4LMNADPP4
SCHEMBL16382235 0.90 CHRNB2 (0.38) CHRNB2CHRNA7CHRNA4LMNADPP4
SCHEMBL12717785 0.88 CHRNB2 (0.42) CHRNB2CHRNA7CHRNA4LMNADPP4
SCHEMBL12717782 0.86 CHRNB2 (0.41) CHRNB2CHRNA7CHRNA4LMNADPP4
SCHEMBL22784190 0.83 CHRNB2 (0.35) CHRNB2CHRNA7CHRNA4LMNACHRNB4
SCHEMBL12718160 0.82 METAP2 (0.34) CHRNB2CHRNA7CHRNA4
SCHEMBL12718156 0.82 METAP2 (0.34) CHRNB2CHRNA7CHRNA4
SCHEMBL9689082 0.81 CHRNB2 (0.60) CHRNB2CHRNA7CHRNA4DPP4CHRNB4
SCHEMBL2477311 0.81 GNAO1 (0.34) CHRNB2CHRNA7CHRNA4

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-4526969-A Trifluoromethyl substituted perfluoro quinolizines THE GREEN CROSS CORPORATION (JP) 1985-07-02 US disclosed