SCHEMBL28831783

SCHEMBL28831783

CC(O)C[N+](C)(C)C.CCC(CC)(CC)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.41
SLC22A16 Q86VW1 1/20 0.36
TSHR P16473 3/20 0.35
CHRM2 P08172 2/20 0.35
CHRM4 P08173 2/20 0.35
CHRM1 P11229 2/20 0.35
TBXA2R P21731 1/20 0.35
LMNA P02545 3/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
CHRM5 P08912 1/20 0.34
CHRM3 P20309 1/20 0.34
CYP2C9 P11712 1/20 0.34
GALR3 O60755 1/20 0.34
BLM P54132 1/20 0.34
CPT2 P23786 1/20 0.31
CPT1A P50416 1/20 0.31

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
SCHEMBL28080473 0.82 CHRM2 (0.32) CHRM2CHRM1CHRM3
SCHEMBL2345842 0.82 SLC22A16 (0.44) MAPTSLC22A16TSHRCHRM2CHRM4
Pivalate SCHEMBL2354481 0.81 MAPT (0.45) MAPTSLC22A16TSHRCHRM2CHRM4
SCHEMBL10909514 0.81 MAPT (0.38) MAPTSLC22A16TSHRCHRM2CHRM4
Bicarbonate SCHEMBL28323258 0.80 MAPT (0.52) MAPTSLC22A16TSHRCHRM2CHRM4
Acetic Acid SCHEMBL28210362 0.78 MAPT (0.50) MAPTSLC22A16TSHRCHRM2CHRM4
Tetramethylammonium Ion SCHEMBL27703784 0.78 FFAR3 (0.35) TSHRLMNA
Bicarbonate SCHEMBL8320369 0.76 SLC22A16 (0.54) MAPTSLC22A16TSHRCHRM2CHRM4
SCHEMBL173322 0.75 FFAR3 (0.41) TSHRCHRM1TBXA2R
SCHEMBL9748138 0.75

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
CN-106102910-B For manufacturing the carbon monoxide-olefin polymeric and method of foam 赢创德固赛有限公司 2019-07-05 CN claimed
CN-106102910-A For manufacturing carbon monoxide-olefin polymeric and the method for foam 气体产品与化学公司 2016-11-09 CN claimed
CN-106102910-B For manufacturing the carbon monoxide-olefin polymeric and method of foam 赢创德固赛有限公司 2019-07-05 CN disclosed
CN-106102910-A For manufacturing carbon monoxide-olefin polymeric and the method for foam 气体产品与化学公司 2016-11-09 CN disclosed