SCHEMBL10694887

SCHEMBL10694887

CCOC(=O)OC1CCCC(C)N1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.39
TSHR P16473 2/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
SOAT1 P35610 1/20 0.36
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 1/20 0.33
KDM4E B2RXH2 2/20 0.32
LMNA P02545 1/20 0.32
THRB P10828 1/20 0.30
ATM Q13315 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
CYP2D6 P10635 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
SCHEMBL2330898 0.77 ALDH1A1 (0.43) ALDH1A1SOAT1LMNATHRBATM
SCHEMBL4014963 0.77 ALDH1A1 (0.43) ALDH1A1SOAT1LMNATHRBATM
SCHEMBL10695554 0.76 CHRM2 (0.34) ALDH1A1CYP2C9CYP2C19SOAT1CHRM2
SCHEMBL6820310 0.76 ALDH1A1 (0.41) ALDH1A1CYP2C9CYP2C19SOAT1KDM4E
SCHEMBL9054793 0.76 SLC6A2 (0.43) ALDH1A1SOAT1THRBATML3MBTL1
SCHEMBL2567582 0.76 SLC6A2 (0.43) ALDH1A1SOAT1THRBATML3MBTL1
SCHEMBL10695661 0.73 CYP2D6 (0.33) ALDH1A1CHRM2CHRM4CHRM1CHRM3
SCHEMBL10589156 0.73 CHRM2 (0.39) ALDH1A1SOAT1CHRM2CHRM4CHRM1
SCHEMBL9335755 0.73 CHRM2 (0.39) ALDH1A1SOAT1CHRM2CHRM4CHRM1
SCHEMBL3637743 0.72 TSHR (0.58) ALDH1A1TSHRCYP2C9CYP2C19TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0272594-A1 Bicyclic imides, process for their preparation and their use in crop protection HOECHST AKTIENGESELLSCHAFT (DE) 1988-06-29 EP disclosed