SCHEMBL17076364

SCHEMBL17076364

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

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM5 P08912 6/20 0.43
CHRM1 P11229 6/20 0.43
CHRM3 P20309 6/20 0.43
CHRM2 P08172 5/20 0.43
CHRM4 P08173 5/20 0.43
CHRNB2 P17787 4/20 0.43
CHRNA4 P43681 4/20 0.43
CHRNA7 P36544 3/20 0.43
HTR1A P08908 2/20 0.43
PGR P06401 1/20 0.43
TBXA2R P21731 1/20 0.43
CHRNB4 P30926 1/20 0.43
CHRNA3 P32297 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CHRNA10 Q9GZZ6 1/20 0.43
CHRNA9 Q9UGM1 1/20 0.43
GALR3 O60755 2/20 0.42
GAA P10253 1/20 0.42
RAB9A P51151 1/20 0.42
ADRA2A P08913 1/20 0.39

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
SCHEMBL80351 0.86 CHRM5 (0.44) CHRM5CHRM1CHRM3CHRM2CHRM4
SCHEMBL14988989 0.83 TSHR (0.45) CHRM5CHRM1CHRM3CHRM2CHRM4
SCHEMBL1260104 0.82 TSHR (0.47) CHRM5CHRM1CHRM3CHRM2CHRM4
SCHEMBL3518542 0.81 THRB (0.47) CHRM5CHRM1CHRM3CHRM2CHRM4
SCHEMBL1260812 0.81 TSHR (0.50) CHRM5CHRM1CHRM3CHRM2CHRM4
Methacrylic Acid SCHEMBL5607196 0.81 CHRM5 (0.40) CHRM5CHRM1CHRM3CHRM2CHRM4
SCHEMBL5673775 0.81 TSHR (0.50) CHRM5CHRM1CHRM3CHRM2CHRM4
SCHEMBL6278177 0.81 THRB (0.46) CHRM5CHRM1CHRM3CHRM2CHRM4
SCHEMBL22289409 0.79 TSHR (0.51) CHRM5CHRM1CHRM3CHRM2CHRM4
Hydrochloric Acid SCHEMBL15954 0.79 CHRM5 (0.65) CHRM5CHRM1CHRM3CHRM2CHRM4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020203998-A1 AMPHIPHILIC COMPOUND, AND RESIN COMPOSITION FOR MEDICAL USE AND DRUG ADDITIVE EACH USING SAME 株式会社日本触媒 2020-10-08 WO disclosed
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