SCHEMBL28779043

SCHEMBL28779043

CC(C)(C)OC(=O)N1CCCC(F)(C(=O)CBr)C1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 2/20 0.46
HPGD P15428 1/20 0.40
USP2 O75604 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
MAPT P10636 2/20 0.37
ALDH1A1 P00352 2/20 0.37
CTSK P43235 1/20 0.35
EPHX1 P07099 1/20 0.35
MMP2 P08253 1/20 0.35
MMP13 P45452 1/20 0.35
MMP14 P50281 1/20 0.35
ADAM17 P78536 1/20 0.35
DDB1 Q16531 1/20 0.35
CRBN Q96SW2 1/20 0.35
RORC P51449 1/20 0.35
NR1H2 P55055 1/20 0.35
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34

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
SCHEMBL20028915 1.00 USP30 (0.46) USP30HPGDUSP2SMN1; SMN2MEN1
SCHEMBL1441490 0.84 USP30 (0.46) USP30HPGDUSP2SMN1; SMN2MEN1
SCHEMBL11931444 0.84 MEN1 (0.53) USP30HPGDUSP2SMN1; SMN2MEN1
SCHEMBL20028676 0.84 USP30 (0.45) USP30HPGDUSP2SMN1; SMN2MEN1
SCHEMBL1439256 0.84 USP30 (0.45) USP30HPGDUSP2SMN1; SMN2MEN1
SCHEMBL19995401 0.82 USP30 (0.42) USP30HPGDUSP2SMN1; SMN2MEN1
SCHEMBL662017 0.81 USP30 (0.42) USP30HPGDUSP2SMN1; SMN2MEN1
SCHEMBL28564135 0.80 HPGD (0.41) USP30HPGDUSP2SMN1; SMN2MEN1
SCHEMBL21145360 0.80 USP30 (0.49) USP30HPGDUSP2SMN1; SMN2MEN1
SCHEMBL1262593 0.79 HPGD (0.45) USP30HPGDUSP2SMN1; SMN2MEN1

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-109790148-B Cyano-substituted heterocycles having USP30 inhibitor activity 特殊治疗有限公司 2022-06-07 CN disclosed