SCHEMBL16247369

SCHEMBL16247369

CCCCCCCCCNC(=O)C(Cc1ccccc1)NC(=O)CCCC

nearest known ligand 0.69

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CHRNB2 P17787 1/20 0.69
▸ CHRNB4 P30926 1/20 0.69
▸ CHRNA3 P32297 1/20 0.69
▸ CHRNA4 P43681 1/20 0.69
▸ GRIA1 P42261 1/20 0.65
▸ CHRND Q07001 6/20 0.61
▸ CHRNA1 P02708 2/20 0.61
▸ CHRNG P07510 2/20 0.61
▸ CHRNB1 P11230 2/20 0.61
▸ PSMB5 P28074 2/20 0.61
▸ CTSB P07858 1/20 0.60
▸ PTPN1 P18031 1/20 0.60
▸ FAAH O00519 2/20 0.60

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
SCHEMBL12324830 1.00 CHRNB2 (0.69) CHRNB2CHRNB4CHRNA3CHRNA4GRIA1
SCHEMBL6438848 0.97 CHRNB2 (0.69) CHRNB2CHRNB4CHRNA3CHRNA4GRIA1
SCHEMBL9519035 0.97 CHRNB2 (0.69) CHRNB2CHRNB4CHRNA3CHRNA4GRIA1
SCHEMBL21356920 0.94 CHRNB2 (0.65) CHRNB2CHRNB4CHRNA3CHRNA4GRIA1
SCHEMBL21356921 0.94 CHRNB2 (0.65) CHRNB2CHRNB4CHRNA3CHRNA4GRIA1
SCHEMBL4740245 0.94 CHRNB2 (0.65) CHRNB2CHRNB4CHRNA3CHRNA4GRIA1
SCHEMBL988166 0.94 CHRNB2 (0.77) CHRNB2CHRNB4CHRNA3CHRNA4GRIA1
SCHEMBL23086284 0.93 PTPN1 (0.68) CHRNB2CHRNB4CHRNA3CHRNA4GRIA1
SCHEMBL985563 0.91 CHRNB2 (0.77) CHRNB2CHRNB4CHRNA3CHRNA4GRIA1
SCHEMBL5817448 0.91 FAAH (0.71) CHRNB2CHRNB4CHRNA3CHRNA4GRIA1

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-8888262-B2 Actinic energy radiation curable inkjet ink and inkjet recording method KONICA MINOLTA HOLDINGS, INC. (JP) 2014-11-18 — — US disclosed
Send feedback