SCHEMBL21607906

SCHEMBL21607906

CC(C)(C)OC(=O)N1CCN(Cc2ncccc2F)C1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.48
▸ GRM5 P41594 2/20 0.46
▸ GRM1 Q13255 2/20 0.46
▸ DTYMK P23919 1/20 0.44
▸ GPR119 Q8TDV5 5/20 0.42
▸ CHRM2 P08172 1/20 0.42
▸ CHRM4 P08173 1/20 0.42
▸ CHRM1 P11229 1/20 0.42
▸ CHRM3 P20309 1/20 0.42
▸ KDM1A O60341 2/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ KDM1B Q8NB78 1/20 0.41
▸ CCNK O75909 1/20 0.41
▸ CDK12 Q9NYV4 1/20 0.41
▸ SQOR Q9Y6N5 1/20 0.41
▸ OPRD1 P41143 1/20 0.40
▸ OPRK1 P41145 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ CYP3A5 P20815 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
SCHEMBL21608350 0.80 POLB (0.47) POLBGRM5GRM1DTYMKGPR119
SCHEMBL9933273 0.79 POLB (0.53) POLBDTYMKGPR119CHRM2CHRM4
SCHEMBL12836021 0.79 POLB (0.53) POLBDTYMKGPR119CHRM2CHRM4
SCHEMBL21607887 0.79 POLB (0.47) POLBDTYMKGPR119CHRM2CHRM4
SCHEMBL21607916 0.77 GPR119 (0.59) POLBGPR119CHRM2CHRM4CHRM1
SCHEMBL20818170 0.76 POLB (0.52) POLBDTYMKGPR119CHRM2CHRM4
SCHEMBL21608123 0.76 KDM1A (0.43) POLBGPR119CHRM2CHRM4CHRM1
SCHEMBL20818805 0.76 POLB (0.49) POLBDTYMKGPR119CHRM2CHRM4
SCHEMBL30476371 0.76 POLB (0.49) POLBDTYMKGPR119CHRM2CHRM4
SCHEMBL21607904 0.76 ALOX5AP (0.53) POLBGPR119KDM4E

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-2019243531-A1 OGA INHIBITOR COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2019-12-26 — — WO disclosed
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