SCHEMBL4251874

SCHEMBL4251874

CC[N+](C)(CC)CCOC.CC[N+](C)(CC)CCOC.F[B-](F)(F)F.F[B-](F)(F)F

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 2/20 0.33
CHRM1 P11229 2/20 0.33
CHRM3 P20309 2/20 0.33
CHRNB4 P30926 1/20 0.32
CHRNA3 P32297 1/20 0.32
CHRNA7 P36544 1/20 0.32
BBOX1 O75936 1/20 0.30
CHRM2 P08172 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
SCHEMBL4251873 1.00 CHRM4 (0.33) CHRM4CHRM1CHRM3CHRNB4CHRNA3
SCHEMBL380262 1.00 CHRM4 (0.33) CHRM4CHRM1CHRM3CHRNB4CHRNA3
SCHEMBL28122082 0.98 CHRM4 (0.32) CHRM4CHRM1CHRM3CHRNB4CHRNA3
SCHEMBL272775 0.90 CHRM1 (0.36) CHRM4CHRM1CHRM3CHRNB4CHRNA3
Water SCHEMBL15361514 0.87 CHRM1 (0.35) CHRM4CHRM1CHRM3CHRNB4CHRNA3
Iodide SCHEMBL1408228 0.87 CHRNB4 (0.38) CHRM4CHRM1CHRM3CHRNB4CHRNA3
Fluoride Ion SCHEMBL15361775 0.87 CHRM1 (0.35) CHRM4CHRM1CHRM3CHRNB4CHRNA3
Bromide SCHEMBL1769810 0.87 CHRM1 (0.39) CHRM4CHRM1CHRM3CHRNB4CHRNA3
Hydrochloric Acid SCHEMBL4146323 0.87 CHRM1 (0.35) CHRM4CHRM1CHRM3CHRNB4CHRNA3
Ammonia Solution, Strong SCHEMBL28074213 0.87 CHRM1 (0.35) CHRM4CHRM1CHRM3CHRNB4CHRNA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8258089-B2 Grease composition IDEMITSU KOSAN CO., LTD. (JP) 2012-09-04 US claimed
US-8258089-B2 Grease composition IDEMITSU KOSAN CO., LTD. (JP) 2012-09-04 US disclosed
US-20090281008-A1 GREASE COMPOSITION IDEMITSU KOSAN CO., LTD. (JP) 2009-11-12 US disclosed
EP-1867706-A1 GREASE COMPOSITION IDEMITSU KOSAN CO., LTD. (JP) 2007-12-19 EP disclosed