SCHEMBL31064869

SCHEMBL31064869

COCNCCNCCNCOCCC(=O)O

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.39
TSHR P16473 3/20 0.36
LMNA P02545 1/20 0.33
PLA2G4B P0C869 1/20 0.32
POLB P06746 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
FFAR3 O14843 1/20 0.30
HDAC3 O15379 1/20 0.30
HDAC1 Q13547 1/20 0.30
HDAC2 Q92769 1/20 0.30
HDAC8 Q9BY41 1/20 0.30

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
SCHEMBL31519000 1.00 ALDH1A1 (0.39) ALDH1A1TSHRLMNAPLA2G4BPOLB
SCHEMBL31629201 1.00 ALDH1A1 (0.39) ALDH1A1TSHRLMNAPLA2G4BPOLB
SCHEMBL24984051 0.86 TSHR (0.40) ALDH1A1TSHRLMNAPOLBFFAR3
SCHEMBL30841598 0.82 EPHX2 (0.30) TSHR
SCHEMBL30715219 0.82 EPHX2 (0.30) TSHR
SCHEMBL30521530 0.82 EGLN1 (0.39) ALDH1A1TSHRPOLB
SCHEMBL8656284 0.81
SCHEMBL31584318 0.81 ALDH1A1 (0.42) ALDH1A1TSHRLMNAL3MBTL1
SCHEMBL30723173 0.78 ALDH1A1 (0.36) ALDH1A1TSHRLMNA
SCHEMBL7191311 0.74 LMNA (0.38) ALDH1A1TSHRLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4661913-A1 SELF-STABILIZING LINKER CONJUGATES Beone Medicines I GmbH (CH) 2025-12-17 EP disclosed
WO-2025124456-A1 ANTIBODY DRUG CONJUGATE PLATFORMS BEIGENE, LTD. (KY) 2025-06-19 WO disclosed
WO-2024165045-A1 SELF-STABILIZING LINKER CONJUGATES BEIGENE, LTD. (KY) 2024-08-15 WO disclosed