SCHEMBL5496431

SCHEMBL5496431

CSC(C(C)=O)(c1ccccc1)N1CCOCC1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.49
OPRM1 P35372 1/20 0.43
OPRD1 P41143 1/20 0.43
ALDH1A1 P00352 4/20 0.43
TSHR P16473 2/20 0.43
MAPK1 P28482 1/20 0.43
KCNA5 P22460 2/20 0.40
LMNA P02545 1/20 0.40
HPGD P15428 1/20 0.40
MAPT P10636 1/20 0.39
ALOX15 P16050 1/20 0.39
POLB P06746 1/20 0.39
GAA P10253 2/20 0.39
FKBP1A P62942 1/20 0.38
HTT P42858 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38

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
SCHEMBL5486113 0.85 OPRM1 (0.59) SMN1; SMN2OPRM1OPRD1ALDH1A1TSHR
SCHEMBL8817476 0.73 SMN1; SMN2 (0.52) SMN1; SMN2OPRM1OPRD1ALDH1A1TSHR
SCHEMBL3312757 0.72 SMN1; SMN2 (0.58) SMN1; SMN2OPRM1OPRD1ALDH1A1TSHR
SCHEMBL2223625 0.71 ALDH1A1 (0.56) SMN1; SMN2ALDH1A1TSHRMAPK1LMNA
SCHEMBL28845914 0.70 SMN1; SMN2 (0.49) SMN1; SMN2OPRM1OPRD1ALDH1A1KCNA5
SCHEMBL10889012 0.70 ALDH1A1 (0.69) SMN1; SMN2OPRM1OPRD1ALDH1A1TSHR
SCHEMBL11541844 0.69 SMN1; SMN2 (0.54) SMN1; SMN2OPRM1OPRD1ALDH1A1TSHR
SCHEMBL11541847 0.69 SMN1; SMN2 (0.54) SMN1; SMN2OPRM1OPRD1ALDH1A1KCNA5
SCHEMBL18889556 0.69 OPRM1 (0.60) SMN1; SMN2OPRM1OPRD1ALDH1A1KCNA5
SCHEMBL7447904 0.69 OPRM1 (0.47) SMN1; SMN2OPRM1OPRD1ALDH1A1TSHR

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
WO-2007067466-A2 DIGITAL PRINTING USING ULTRAVIOLET INKS GENERAL ELECTRIC COMPANY (US) 2007-06-14 WO claimed