SCHEMBL26294765

SCHEMBL26294765

CC(C)OC(=O)N1CC(C(C)C)C1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CHRNB2 P17787 3/20 0.38
▸ CHRNA4 P43681 3/20 0.38
▸ CHRNB4 P30926 1/20 0.38
▸ CHRNA3 P32297 1/20 0.38
▸ TSHR P16473 1/20 0.37
▸ HDAC2 Q92769 1/20 0.36
▸ PDE4B Q07343 2/20 0.35
▸ GPR119 Q8TDV5 3/20 0.34
▸ HSD11B1 P28845 1/20 0.33
▸ P2RX4 Q99571 1/20 0.33
▸ NR1H2 P55055 1/20 0.33
▸ BCHE P06276 1/20 0.33
▸ KCNK3 O14649 1/20 0.32
▸ KCNK9 Q9NPC2 1/20 0.32
▸ RORC P51449 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
SCHEMBL21149313 0.83 HDAC2 (0.38) CHRNB2CHRNA4CHRNB4CHRNA3TSHR
SCHEMBL21025382 0.83 CHRNB2 (0.52) CHRNB2CHRNA4CHRNB4CHRNA3TSHR
SCHEMBL12206738 0.83 CHRNB2 (0.38) CHRNB2CHRNA4CHRNB4CHRNA3TSHR
SCHEMBL10139547 0.83 CHRNB2 (0.50) CHRNB2CHRNA4CHRNB4CHRNA3TSHR
SCHEMBL30674446 0.81 CHRNB2 (0.47) CHRNB2CHRNA4CHRNB4CHRNA3TSHR
SCHEMBL20343638 0.79 HSD11B1 (0.42) CHRNB2CHRNA4CHRNB4CHRNA3TSHR
SCHEMBL19686575 0.79 CHRNB2 (0.40) CHRNB2CHRNA4CHRNB4CHRNA3TSHR
SCHEMBL19686595 0.79 CHRNB2 (0.37) CHRNB2CHRNA4CHRNB4CHRNA3TSHR
SCHEMBL14752960 0.79 MAPT (0.39) CHRNB2CHRNA4CHRNB4CHRNA3TSHR
SCHEMBL2603257 0.79 GPR119 (0.44) PDE4BGPR119

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-2023172737-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF KUMQUAT BIOSCIENCES INC. (US) 2023-09-14 — — WO disclosed
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