SCHEMBL30142954

SCHEMBL30142954

CCOC(=O)[C@]1(C)CCCC[C@]1(C)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.41
OPRM1 P35372 5/20 0.37
OPRD1 P41143 3/20 0.36
OPRK1 P41145 3/20 0.36
SLC22A1 O15245 1/20 0.36
SLC6A4 P31645 1/20 0.36
ADRA1A P35348 1/20 0.36
KCNH2 Q12809 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
KDM4E B2RXH2 1/20 0.35
MAPT P10636 1/20 0.35
ALOX15 P16050 1/20 0.35
POLB P06746 1/20 0.35
ALDH1A1 P00352 4/20 0.34
FFAR3 O14843 1/20 0.33
LMNA P02545 1/20 0.33
HSD17B10 Q99714 1/20 0.33
ATM Q13315 1/20 0.33
GAA P10253 1/20 0.33

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
SCHEMBL21950871 0.83 SMN1; SMN2 (0.36) SMN1; SMN2OPRM1OPRD1OPRK1SLC22A1
SCHEMBL1479275 0.82 SMN1; SMN2 (0.38) SMN1; SMN2OPRM1OPRD1OPRK1SLC22A1
SCHEMBL3144178 0.80 POLB (0.41) SMN1; SMN2OPRM1OPRD1OPRK1SLC22A1
SCHEMBL10783276 0.79 FFAR3 (0.39) POLBALDH1A1FFAR3LMNA
SCHEMBL28611189 0.78 SMN1; SMN2 (0.41) SMN1; SMN2OPRM1OPRD1OPRK1SLC22A1
SCHEMBL21950902 0.78 FFAR3 (0.50) SMN1; SMN2POLBALDH1A1FFAR3LMNA
SCHEMBL21950905 0.78 FFAR3 (0.50) SMN1; SMN2POLBALDH1A1FFAR3LMNA
SCHEMBL3670832 0.78 FFAR3 (0.50) SMN1; SMN2POLBALDH1A1FFAR3LMNA
SCHEMBL28409265 0.77 ALDH1A1 (0.34) MEN1KMT2AALDH1A1FFAR3
SCHEMBL3387382 0.76 ALDH1A1 (0.42) ALDH1A1

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
CN-111171195-B Propylene polymerization solid catalyst for reducing VOC and method for producing polypropylene using the same 韩华道达尔能源有限公司 2022-12-27 CN disclosed