SCHEMBL24935548

SCHEMBL24935548

C=C(C)COCCCCOc1ccc(CC)cc1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.47
ALDH1A1 P00352 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
MAPT P10636 1/20 0.47
HPGD P15428 1/20 0.47
HRH3 Q9Y5N1 2/20 0.46
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
KDM4E B2RXH2 1/20 0.43
USP2 O75604 1/20 0.42
CYP3A4 P08684 1/20 0.42
MAPK1 P28482 1/20 0.42
CASP1 P29466 1/20 0.42
SLCO1B3 Q9NPD5 1/20 0.42
SLCO1B1 Q9Y6L6 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
PLA2G4B P0C869 2/20 0.42
GAA P10253 1/20 0.41

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
SCHEMBL12566176 0.83 NR5A1 (0.56) L3MBTL1PLA2G4BGAA
SCHEMBL12035980 0.83 RAB9A (0.49) LMNAALDH1A1SMN1; SMN2MAPTHPGD
SCHEMBL17445912 0.80 ALDH1A1 (0.66) LMNAALDH1A1SMN1; SMN2MAPTHPGD
SCHEMBL23267023 0.79 LMNA (0.54) LMNAALDH1A1SMN1; SMN2MAPTHPGD
SCHEMBL17445914 0.78 HRH3 (0.64) LMNAALDH1A1SMN1; SMN2MAPTHPGD
SCHEMBL9223916 0.78 HTT (0.63) ALDH1A1USP2MAPK1L3MBTL1PLA2G4B
SCHEMBL9501340 0.77 HTT (0.66) ALDH1A1L3MBTL1PLA2G4BGAA
SCHEMBL2944311 0.77 HTT (0.66) ALDH1A1L3MBTL1PLA2G4BGAA
SCHEMBL24674912 0.77 PLA2G4B (0.54) LMNAALDH1A1SMN1; SMN2MAPTHPGD
SCHEMBL8962570 0.77 HTT (0.66) ALDH1A1L3MBTL1PLA2G4BGAA

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-4119546-A1 BIFUNCTIONAL COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF Suzhou Kintor Pharmaceuticals, Inc. (CN) 2023-01-18 EP disclosed