SCHEMBL29067375

SCHEMBL29067375

CCOC(=O)C1(C(C)N)CC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.38
POLB P06746 1/20 0.36
ALDH1A1 P00352 2/20 0.36
OPRM1 P35372 6/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
LMNA P02545 1/20 0.34
HSD17B10 Q99714 1/20 0.34
OPRD1 P41143 3/20 0.34
OPRK1 P41145 3/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
ATM Q13315 1/20 0.34
SLC22A1 O15245 1/20 0.34
SLC6A4 P31645 1/20 0.34
ADRA1A P35348 1/20 0.34
KCNH2 Q12809 1/20 0.34
KCNA3 P22001 1/20 0.34
MGAM O43451 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
SCHEMBL29067373 1.00 ALOX15 (0.38) ALOX15POLBALDH1A1OPRM1SMN1; SMN2
SCHEMBL12868735 0.83 ALDH1A1 (0.39) ALOX15POLBALDH1A1OPRM1SMN1; SMN2
SCHEMBL7862903 0.79 ALDH1A1 (0.35) ALOX15POLBALDH1A1OPRM1SMN1; SMN2
SCHEMBL1257005 0.78 OPRM1 (0.38) ALOX15POLBALDH1A1OPRM1SMN1; SMN2
SCHEMBL10434742 0.77 ALOX15 (0.35) ALOX15POLBALDH1A1OPRM1SMN1; SMN2
SCHEMBL29067374 0.77 NPSR1 (0.42) LMNACYP2C9
SCHEMBL29067372 0.77 NPSR1 (0.42) LMNACYP2C9
SCHEMBL29067370 0.77 NPSR1 (0.42) LMNACYP2C9
SCHEMBL16369822 0.76 POLB (0.36) ALOX15POLBALDH1A1OPRM1SMN1; SMN2
SCHEMBL14504414 0.76 SMN1; SMN2 (0.41) ALOX15POLBALDH1A1OPRM1SMN1; SMN2

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-116730849-A Preparation method of optically active [1- (1-amino ethyl) cyclopropyl ] methanol 江苏艾迪药业股份有限公司 2023-09-12 CN disclosed