SCHEMBL30639643

SCHEMBL30639643

COCCN1CCCC1C(N)=O

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.41
GBA1 P04062 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.40
SPHK1 Q9NYA1 1/20 0.39
ALDH1A1 P00352 2/20 0.38
MAPT P10636 1/20 0.38
SCN3A Q9NY46 1/20 0.38
POLB P06746 1/20 0.37
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
DPP4 P27487 1/20 0.37
LMNA P02545 1/20 0.37
HTT P42858 1/20 0.36
GAA P10253 1/20 0.36
NR1I2 O75469 1/20 0.35

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
SCHEMBL14155228 0.90 SCN3A (0.39) LTA4HSMN1; SMN2SPHK1SCN3APOLB
SCHEMBL4959171 0.85 LTA4H (0.45) LTA4HGBA1SMN1; SMN2
SCHEMBL4959163 0.85 LTA4H (0.45) LTA4HGBA1SMN1; SMN2
SCHEMBL6568062 0.85 LTA4H (0.45) LTA4HGBA1SMN1; SMN2
SCHEMBL23715749 0.83 LTA4H (0.56) LTA4HGBA1ALDH1A1MAPTPOLB
SCHEMBL16418012 0.83 LTA4H (0.56) LTA4HGBA1ALDH1A1MAPTPOLB
SCHEMBL4555126 0.83 SPHK1 (0.40) SMN1; SMN2SPHK1SCN3APOLBMAOA
SCHEMBL18555352 0.83 SPHK1 (0.40) SMN1; SMN2SPHK1SCN3APOLBMAOA
SCHEMBL3289140 0.81 LMNA (0.47) SMN1; SMN2SPHK1ALDH1A1SCN3APOLB
SCHEMBL3289131 0.81 LMNA (0.47) SMN1; SMN2SPHK1ALDH1A1SCN3APOLB

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4504720-A1 GCN2 MODULATOR COMPOUNDS Alesta Therapeutics BV (NL) 2025-02-12 EP disclosed
WO-2023196659-A1 GCN2 MODULATOR COMPOUNDS Alesta Therapeutics BV (NL) 2023-10-12 WO disclosed