SCHEMBL9543516

SCHEMBL9543516

NC1CCC(=O)N1CC(=O)O

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.36
ACE P12821 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
KMT2A Q03164 3/20 0.33
MEN1 O00255 2/20 0.33
GSK3A P49840 1/20 0.33
GSK3B P49841 1/20 0.33
POLB P06746 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PTGER4 P35408 4/20 0.32
PTGER3 P43115 3/20 0.32
PTGER2 P43116 2/20 0.32

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
SCHEMBL9383161 1.00 TSHR (0.36) TSHRACEL3MBTL1KMT2AMEN1
SCHEMBL9382771 1.00 TSHR (0.36) TSHRACEL3MBTL1KMT2AMEN1
Hydrochloric Acid SCHEMBL9384194 0.98 TSHR (0.35) TSHRACEL3MBTL1KMT2AMEN1
Hydrochloric Acid SCHEMBL9543280 0.98 TSHR (0.35) TSHRACEL3MBTL1KMT2AMEN1
Hydrochloric Acid SCHEMBL9382749 0.98 TSHR (0.35) TSHRACEL3MBTL1KMT2AMEN1
SCHEMBL9383119 0.78 ACE (0.36) TSHRACEKMT2APTGER4PTGER3
SCHEMBL9544626 0.78 ACE (0.36) TSHRACEKMT2APTGER4PTGER3
SCHEMBL783054 0.77 CHRM2 (0.46) TSHRACEKMT2AMEN1POLB
SCHEMBL6694973 0.77 ACE (0.44) TSHRACEKMT2AMEN1GSK3A
SCHEMBL29150853 0.76 ACE (0.43) TSHRACEKMT2AMEN1POLB

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-1993009120-A1 PROCESS FOR THE PREPARATION OF CONDENSED IMIDAZOLES SMITHKLINE BEECHAM FARMACEUTICI S.P.A. (IT) 1993-05-13 WO disclosed