SCHEMBL31438435

SCHEMBL31438435

CCC=CCCCCN[C@@H](C)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.50
MAPT P10636 3/20 0.50
SMN1; SMN2 Q16637 1/20 0.47
SLC6A5 Q9Y345 1/20 0.47
F7 P08709 3/20 0.45
F3 P13726 3/20 0.45
CYP19A1 P11511 3/20 0.45
OXER1 Q8TDS5 2/20 0.45
PTGS1 P23219 2/20 0.45
PPARG P37231 2/20 0.45
KMT2A Q03164 2/20 0.45
PPARD Q03181 2/20 0.45
PPARA Q07869 2/20 0.45
KDM4E B2RXH2 1/20 0.45
MEN1 O00255 1/20 0.45
FFAR1 O14842 1/20 0.45
NR1I2 O75469 1/20 0.45
LMNA P02545 1/20 0.45
PLA2G1B P04054 1/20 0.45
CYP3A4 P08684 1/20 0.45

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
SCHEMBL7940500 0.88 FAAH (0.56) MAPTSMN1; SMN2SLC6A5F7F3
SCHEMBL9656107 0.88 FAAH (0.56) MAPTSMN1; SMN2SLC6A5F7F3
SCHEMBL2850175 0.88 FAAH (0.56) MAPTSMN1; SMN2SLC6A5F7F3
SCHEMBL7940508 0.88 FAAH (0.56) MAPTSMN1; SMN2SLC6A5F7F3
SCHEMBL6703351 0.85 SMN1; SMN2 (0.65) ALDH1A1MAPTSMN1; SMN2SLC6A5F7
SCHEMBL6703349 0.85 SMN1; SMN2 (0.65) ALDH1A1MAPTSMN1; SMN2SLC6A5F7
SCHEMBL3235476 0.85 SMN1; SMN2 (0.65) ALDH1A1MAPTSMN1; SMN2SLC6A5F7
SCHEMBL3235483 0.85 SMN1; SMN2 (0.65) ALDH1A1MAPTSMN1; SMN2SLC6A5F7
SCHEMBL2804328 0.79 KDM4E (0.39) ALDH1A1SMN1; SMN2KDM4EHSD17B10FAAH
SCHEMBL25481345 0.77 ALDH1A1 (0.38) ALDH1A1MAPTF7F3CYP19A1

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-2025027389-A1 BIOLOGICALLY ACTIVE COMPOUNDS COMPRISING A STAPLED OR STITCHED PEPTIDE SUTURA THERAPEUTICS LIMITED (GB) 2025-02-06 WO disclosed