SCHEMBL21881955

SCHEMBL21881955

CCC[C@H]1CN(C(C)CC)C(=O)CC1C

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.42
KMT2A Q03164 1/20 0.33
MAPT P10636 1/20 0.33
PGR P06401 1/20 0.30
NOS1 P29475 2/20 0.30
NOS2 P35228 2/20 0.30
NOS3 P29474 1/20 0.30

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
SCHEMBL21881954 0.80 LMNA (0.46) TSHRKMT2AMAPTNOS1NOS2
SCHEMBL21881994 0.79 TSHR (0.45) TSHRMAPTPGRNOS1NOS2
SCHEMBL21881956 0.79 TSHR (0.45) TSHRMAPTPGRNOS1NOS2
SCHEMBL18821137 0.76 TSHR (0.48) TSHRKMT2AMAPTPGR
SCHEMBL21881998 0.73 TSHR (0.32) TSHR
SCHEMBL23102951 0.71 TSHR (0.47) TSHRKMT2AMAPTPGR
SCHEMBL10411482 0.69 TSHR (0.45) TSHRMAPTPGR
SCHEMBL14145690 0.69 TSHR (0.48) TSHRMAPTPGR
SCHEMBL14145833 0.68 TSHR (0.60) TSHRKMT2AMAPT
SCHEMBL11997219 0.68 MAPT (0.72) TSHRKMT2AMAPT

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-2020052545-A1 METHOD FOR PREPARING BRIVARACETAM AND INTERMEDIATES THEREOF 上海宣泰医药科技有限公司 2020-03-19 WO disclosed