SCHEMBL24747258

SCHEMBL24747258

CN1CCC2(CC1)CCN(C(=O)C1CC1)C2

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 1/20 0.56
HTT P42858 1/20 0.50
HRH3 Q9Y5N1 1/20 0.45
LMNA P02545 1/20 0.45
HPGD P15428 1/20 0.42
ITGB3 P05106 5/20 0.41
ITGA2B P08514 5/20 0.41
USP2 O75604 1/20 0.41
CHRNB2 P17787 1/20 0.40
CHRNA3 P32297 1/20 0.40
CHRNA4 P43681 1/20 0.40
CHRNB3 Q05901 1/20 0.40
CHRNA6 Q15825 1/20 0.40
HSD11B1 P28845 1/20 0.40
EPHX2 P34913 2/20 0.39
ALDH1A1 P00352 1/20 0.38
TSHR P16473 1/20 0.38
CYP1A2 P05177 1/20 0.38
HIF1A Q16665 1/20 0.37

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
SCHEMBL18713240 0.91 HTT (0.51) GRM5HTTHRH3LMNAHPGD
SCHEMBL16730387 0.89 GRM5 (0.51) GRM5HTTHRH3LMNAHPGD
SCHEMBL19158899 0.89 GRM5 (0.62) GRM5HTTHRH3HPGDITGB3
SCHEMBL20159548 0.86 GRM5 (0.49) GRM5HTTHRH3LMNAHPGD
SCHEMBL25571575 0.86 GRM5 (0.47) GRM5HTTHRH3LMNAHPGD
SCHEMBL12683549 0.85 GRM5 (0.69) GRM5HTTHRH3HPGDITGB3
SCHEMBL18713241 0.84 GRM5 (0.58) GRM5HTTHRH3LMNAHPGD
SCHEMBL18390027 0.84 LMNA (0.56) GRM5HTTLMNAHPGDITGB3
SCHEMBL18713235 0.83 LMNA (0.58) GRM5HTTLMNAHPGDITGB3
SCHEMBL20159545 0.82 GRM5 (0.45) GRM5HTTHRH3LMNAITGB3

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-2022174253-A1 HPK1 ANTAGONISTS AND USES THEREOF Nimbus Saturn, Inc. (US) 2022-08-18 WO disclosed