SCHEMBL17076360

SCHEMBL17076360

C=C(C)C(=O)OC(CC)C[PH](=O)OCC[N+](C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM5 P08912 2/20 0.33
CHRM1 P11229 2/20 0.33
CHRM3 P20309 2/20 0.33
PGR P06401 1/20 0.33
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
HTR1A P08908 1/20 0.33
CHRNB2 P17787 1/20 0.33
TBXA2R P21731 1/20 0.33
CHRNB4 P30926 1/20 0.33
CHRNA3 P32297 1/20 0.33
CHRNA7 P36544 1/20 0.33
CHRNA4 P43681 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CHRNA10 Q9GZZ6 1/20 0.33
CHRNA9 Q9UGM1 1/20 0.33
GALR3 O60755 2/20 0.33
GAA P10253 1/20 0.33
RAB9A P51151 1/20 0.33
THRB P10828 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
SCHEMBL28508063 0.83 CHRM1 (0.35) CHRM5CHRM1CHRM3PGRCHRM2
SCHEMBL17076331 0.81 HPGD (0.31) CHRM5CHRM1CHRM3PGRCHRM2
SCHEMBL27552593 0.76 TSHR (0.35) CHRM5CHRM1CHRM3PGRCHRM2
Hydrochloric Acid SCHEMBL27513614 0.75 THRB (0.36) CHRM5CHRM1CHRM3PGRCHRM2
SCHEMBL572696 0.74 CHRM1 (0.37) CHRM5CHRM1CHRM3PGRCHRM2
SCHEMBL28701633 0.74 CHRM5 (0.37) CHRM5CHRM1CHRM3PGRCHRM2
SCHEMBL17076364 0.74 CHRM5 (0.43) CHRM5CHRM1CHRM3PGRCHRM2
SCHEMBL80351 0.73 CHRM5 (0.44) CHRM5CHRM1CHRM3PGRCHRM2
SCHEMBL6293186 0.72 CHRM1 (0.35) CHRM5CHRM1CHRM3PGRCHRM2
Methacrylic Acid SCHEMBL28676577 0.72 CHRM1 (0.40) CHRM5CHRM1CHRM3PGRCHRM2

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-9434858-B2 Hydrophilic coating agent OSAKA ORGANIC CHEMICAL INDUSTRY LTD. (JP) 2016-09-06 US disclosed
US-20150259570-A1 HYDROPHILIC COATING AGENT OSAKA ORGANIC CHEMICAL INDUSTRY LTD. (JP) 2015-09-17 US disclosed