SCHEMBL11547731

SCHEMBL11547731

C1CNC[C@@H]2CCC[C@H]2C1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SLC6A1 P30531 2/20 0.41
SLC6A11 P48066 1/20 0.41
TSHR P16473 1/20 0.41
LMNA P02545 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
SLC6A13 Q9NSD5 1/20 0.41
HTR2C P28335 1/20 0.39
APLNR P35414 2/20 0.39
KDM4E B2RXH2 1/20 0.39
MAPT P10636 1/20 0.39
KMT2A Q03164 1/20 0.39
ATM Q13315 1/20 0.39
NOS2 P35228 1/20 0.39
CYP2D6 P10635 1/20 0.39
ALDH1A1 P00352 1/20 0.39
CCR5 P51681 1/20 0.37
CPN1 P15169 1/20 0.31
CPB2 Q96IY4 1/20 0.31

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
SCHEMBL11577079 1.00 SLC6A1 (0.41) SLC6A1SLC6A11TSHRLMNASMN1; SMN2
SCHEMBL6630533 1.00 SLC6A1 (0.41) SLC6A1SLC6A11TSHRLMNASMN1; SMN2
SCHEMBL23731963 1.00 SLC6A1 (0.41) SLC6A1SLC6A11TSHRLMNASMN1; SMN2
SCHEMBL16877745 0.94
SCHEMBL6631735 0.94 ALDH1A1 (0.47) SLC6A1SLC6A11TSHRLMNASMN1; SMN2
SCHEMBL6096270 0.94 ALDH1A1 (0.47) SLC6A1SLC6A11TSHRLMNASMN1; SMN2
SCHEMBL6914056 0.94
SCHEMBL14119931 0.94
SCHEMBL660990 0.94 SLC6A1 (0.44) SLC6A1SLC6A11TSHRLMNASMN1; SMN2
Chloromethane SCHEMBL23705574 0.92 SLC6A1 (0.37) SLC6A1SLC6A11TSHRLMNASMN1; SMN2

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
US-4141893-A Decahydrocyclopent[c]azepines ELI LILLY AND COMPANY (US) 1979-02-27 US disclosed