SCHEMBL14604907

SCHEMBL14604907

CC(C)(C)OC(=O)N1CCN(C/C=C/CCl)CC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ USP2 O75604 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ CHRM2 P08172 1/20 0.43
▸ CHRM4 P08173 1/20 0.43
▸ CHRM1 P11229 1/20 0.43
▸ CHRM3 P20309 1/20 0.43
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ HPGD P15428 1/20 0.39
▸ VEGFA P15692 1/20 0.39
▸ EGLN1 Q9GZT9 1/20 0.39
▸ EPHX2 P34913 1/20 0.39
▸ ALDH1A1 P00352 3/20 0.39
▸ POLB P06746 1/20 0.39
▸ ABCB1 P08183 1/20 0.38
▸ MAPT P10636 2/20 0.38
▸ STS P08842 1/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ HTT P42858 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
SCHEMBL26430057 0.84 USP2 (0.47) USP2SMN1; SMN2CHRM2CHRM4CHRM1
SCHEMBL14165640 0.82 USP2 (0.45) USP2SMN1; SMN2CHRM2CHRM4CHRM1
SCHEMBL14165639 0.82 USP2 (0.45) USP2SMN1; SMN2CHRM2CHRM4CHRM1
SCHEMBL17532546 0.82 USP2 (0.45) USP2SMN1; SMN2CHRM2CHRM4CHRM1
SCHEMBL1498905 0.81 USP2 (0.50) USP2SMN1; SMN2CHRM2CHRM4CHRM1
SCHEMBL7447764 0.80 USP2 (0.49) USP2SMN1; SMN2CHRM2CHRM4CHRM1
SCHEMBL2086130 0.79 USP2 (0.43) USP2SMN1; SMN2CHRM2CHRM4CHRM1
SCHEMBL30418583 0.79 USP2 (0.43) USP2SMN1; SMN2CHRM2CHRM4CHRM1
SCHEMBL1498991 0.79 USP2 (0.43) USP2SMN1; SMN2CHRM2CHRM4CHRM1
SCHEMBL1498893 0.79 USP2 (0.43) USP2SMN1; SMN2CHRM2CHRM4CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7169786-B2 Isoxazoline derivatives as anti-depressants JANSSEN-CILAG S.A. (ES) 2007-01-30 — — US disclosed
US-7169786-B2 Isoxazoline derivatives as anti-depressants JANSSEN-CILAG S.A. (ES) 2007-01-30 — — US disclosed
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