SCHEMBL16358933

SCHEMBL16358933

CC[C@H](C)[C@@H](C(N)=O)N1C(=O)CCC1C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA3 P07451 1/20 0.38
CA4 P22748 1/20 0.38
CA6 P23280 1/20 0.38
CA5A P35218 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
CA13 Q8N1Q1 1/20 0.38
CA14 Q9ULX7 1/20 0.38
CA5B Q9Y2D0 1/20 0.38
DPP4 P27487 7/20 0.34
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
CHRM5 P08912 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 1/20 0.33
TSHR P16473 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
SCHEMBL25609771 0.83 PER2 (0.32) LMNACA12CA1CA2CA3
SCHEMBL13075166 0.80 LMNA (0.51) LMNACA12CA1CA2CA3
SCHEMBL13075650 0.78 KMT2A (0.38) LMNACA12CA1CA2CA3
SCHEMBL17305513 0.76 RAB9A (0.35) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL19420021 0.74 ALDH1A1 (0.38) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL15185931 0.74 LMNA (0.41) LMNACA12CA1CA2CA3
SCHEMBL4338411 0.70 PER2 (0.37) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL24731109 0.69 TSHR (0.38) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL22541564 0.69 TSHR (0.38) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL4338609 0.69 TSHR (0.38) CHRM2CHRM4CHRM5CHRM1CHRM3

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-2010053548-A2 PTHR1 RECEPTOR COMPOUNDS ANCHOR THERAPEUTICS, INC. (US) 2010-05-14 WO disclosed