SCHEMBL22720334

SCHEMBL22720334

CC(C)(C)OC(=O)N1CCN2C(=O)CCCC2C1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 2/20 0.46
USP30 Q70CQ3 2/20 0.45
MAPT P10636 2/20 0.42
KDM4E B2RXH2 1/20 0.42
THRB P10828 1/20 0.42
DDB1 Q16531 2/20 0.42
CRBN Q96SW2 2/20 0.42
HPGD P15428 1/20 0.42
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
KMT2A Q03164 1/20 0.41
VNN1 O95497 2/20 0.40
GPR119 Q8TDV5 1/20 0.40
TP53 P04637 1/20 0.40
EPHX1 P07099 1/20 0.40

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
SCHEMBL31027198 0.92 USP30 (0.47) FPR2USP30MAPTKDM4ETHRB
SCHEMBL23422324 0.92 USP30 (0.47) FPR2USP30MAPTKDM4ETHRB
SCHEMBL14815454 0.92 USP30 (0.47) FPR2USP30MAPTKDM4ETHRB
SCHEMBL7891812 0.91 FPR2 (0.50) FPR2USP30MAPTKDM4ETHRB
SCHEMBL7888040 0.91 FPR2 (0.50) FPR2USP30MAPTKDM4ETHRB
SCHEMBL3712249 0.91 FPR2 (0.50) FPR2USP30MAPTKDM4ETHRB
SCHEMBL1441557 0.90 FPR2 (0.49) FPR2USP30MAPTKDM4ETHRB
SCHEMBL1441554 0.90 FPR2 (0.49) FPR2USP30MAPTKDM4ETHRB
SCHEMBL21201857 0.89 VNN1 (0.50) FPR2USP30MAPTKDM4ETHRB
SCHEMBL24710446 0.88 FPR2 (0.48) FPR2USP30MAPTKDM4ETHRB

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-2020239123-A1 AROMATIC HETEROCYCLIC DERIVATIVE MODULATOR AND PREPARATION METHOD THEREFOR AND USE THEREOF 上海翰森生物医药科技有限公司 2020-12-03 WO disclosed