SCHEMBL9854151

SCHEMBL9854151

CC(C)=C(C)C(=O)OCCC(O)(O)O

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM5 P08912 2/20 0.34
CHRM1 P11229 2/20 0.34
CHRM3 P20309 2/20 0.34
THRB P10828 1/20 0.31
PGR P06401 1/20 0.31
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31
HTR1A P08908 1/20 0.31
CHRNB2 P17787 1/20 0.31
TBXA2R P21731 1/20 0.31
CHRNB4 P30926 1/20 0.31
CHRNA3 P32297 1/20 0.31
CHRNA7 P36544 1/20 0.31
CHRNA4 P43681 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CHRNA10 Q9GZZ6 1/20 0.31
CHRNA9 Q9UGM1 1/20 0.31
TSHR P16473 2/20 0.31
MAPT P10636 1/20 0.30
BLM P54132 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
SCHEMBL3363403 0.88 TSHR (0.36) CHRM5CHRM1CHRM3TSHRGALR3
SCHEMBL241532 0.83 CHRM5 (0.34) CHRM5CHRM1CHRM3THRBPGR
SCHEMBL8977855 0.79 THRB (0.33) CHRM5CHRM1CHRM3THRBTSHR
SCHEMBL11599572 0.79 CHRM5 (0.32) CHRM5CHRM1CHRM3
SCHEMBL7772992 0.79 CHRM5 (0.32) CHRM5CHRM1CHRM3
SCHEMBL23637 0.79 CHRM5 (0.32) CHRM5CHRM1CHRM3SMN1; SMN2
SCHEMBL10349505 0.78 THRB (0.53) CHRM5CHRM1CHRM3THRBTSHR
SCHEMBL10391730 0.78 CHRM5 (0.31) CHRM5CHRM1CHRM3
SCHEMBL212681 0.78 CHRM5 (0.31) CHRM5CHRM1CHRM3
SCHEMBL3420729 0.78 CHRM5 (0.31) CHRM5CHRM1CHRM3

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
EP-0416616-A2 Process for preparing composite hollow particles NIPPON PAINT CO., LTD. (JP) 1991-03-13 EP disclosed
EP-0251228-A2 Photosensitive flexographic printing plate Nippon Paint Co., Ltd. (JP) 1988-01-07 EP disclosed