SCHEMBL20028847

SCHEMBL20028847

CC(C)(C)OC(=O)N1CCCC(F)(c2nc3cc(Br)cnc3o2)C1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 4/20 0.46
SCD5 Q86SK9 1/20 0.37
CYP11B2 P19099 1/20 0.36
PIK3R1 P27986 5/20 0.36
PIK3CA P42336 5/20 0.36
GPR119 Q8TDV5 6/20 0.36
RORC P51449 1/20 0.35
HDAC4 P56524 1/20 0.35
CKS1B P61024 1/20 0.35
SKP1 P63208 1/20 0.35
SKP2 Q13309 1/20 0.35

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
SCHEMBL20028889 0.85 USP30 (0.47) USP30SCD5PIK3CAGPR119RORC
SCHEMBL20028690 0.85 USP30 (0.47) USP30SCD5PIK3CAGPR119RORC
SCHEMBL20028842 0.81 USP30 (0.68) USP30SCD5GPR119
SCHEMBL28779051 0.80 USP30 (0.42) USP30CYP11B2PIK3R1PIK3CA
SCHEMBL20028899 0.76 USP30 (0.41) USP30CYP11B2PIK3R1PIK3CARORC
SCHEMBL29679555 0.75 USP30 (0.46) USP30SCD5GPR119RORC
SCHEMBL20028867 0.75 USP30 (0.46) USP30SCD5GPR119RORC
SCHEMBL20028870 0.75 USP30 (0.46) USP30SCD5GPR119RORC
SCHEMBL10163290 0.74 USP30 (0.42) USP30SCD5CYP11B2PIK3R1PIK3CA
SCHEMBL20028693 0.73 USP30 (0.41) USP30SCD5PIK3CAGPR119

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 3 patents. 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
EP-3519397-B1 CYANO-SUBTITUTED HETEROCYCLES WITH ACTIVITY AS INHIBITORS OF USP30 MISSION THERAPEUTICS LTD (GB) 2021-05-19 EP disclosed
WO-2018060691-A1 CYANO-SUBTITUTED HETEROCYCLES WITH ACTIVITY AS INHIBITORS OF USP30 MISSION THERAPEUTICS LIMITED (GB) 2018-04-05 WO disclosed