SCHEMBL25224934

SCHEMBL25224934

CN(C(=O)O)[C@@H]1CCCCNC1

nearest known ligand 0.41

Predicted protein targets (top 20)

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
ALDH1A1 P00352 1/20 0.40
SLC6A4 P31645 9/20 0.39
SLC6A2 P23975 8/20 0.39
KCNH2 Q12809 3/20 0.39
SLC6A3 Q01959 4/20 0.37
ATM Q13315 2/20 0.36
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36
KMT2A Q03164 1/20 0.36
CYP2D6 P10635 1/20 0.36
CPN1 P15169 1/20 0.33
CPB2 Q96IY4 1/20 0.33
PAK4 O96013 1/20 0.33
USP30 Q70CQ3 1/20 0.33

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
SCHEMBL25270168 1.00 SLC6A1 (0.41) SLC6A1SLC6A11TSHRLMNASMN1; SMN2
SCHEMBL477375 0.94 SLC6A1 (0.47) SLC6A1SLC6A11TSHRLMNASMN1; SMN2
SCHEMBL4017478 0.94 SLC6A1 (0.47) SLC6A1SLC6A11TSHRLMNASMN1; SMN2
SCHEMBL25222580 0.94 SLC6A1 (0.47) SLC6A1SLC6A11TSHRLMNASMN1; SMN2
Hydrochloric Acid SCHEMBL4020094 0.93 SLC6A1 (0.46) SLC6A1SLC6A11TSHRLMNASMN1; SMN2
Hydrochloric Acid SCHEMBL4014841 0.93 SLC6A1 (0.46) SLC6A1SLC6A11TSHRLMNASMN1; SMN2
Hydrochloric Acid SCHEMBL4021040 0.93 SLC6A1 (0.46) SLC6A1SLC6A11TSHRLMNASMN1; SMN2
Oxalic Acid SCHEMBL4020914 0.91 SLC6A1 (0.44) SLC6A1SLC6A11TSHRLMNASMN1; SMN2
SCHEMBL856746 0.86 SLC6A4 (0.48) SLC6A1SLC6A11SLC6A13SLC6A4SLC6A2
SCHEMBL1221396 0.86 SLC6A4 (0.48) SLC6A1SLC6A11SLC6A13SLC6A4SLC6A2

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
EP-4192587-A1 BTK INHIBITORS Biogen MA Inc. (US) 2023-06-14 EP disclosed