SCHEMBL25520437

SCHEMBL25520437

O=Cc1cc(F)c(F)c(I)c1

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
KIF11 P52732 1/20 0.32
CES2 O00748 1/20 0.30
CES1 P23141 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
SCHEMBL23754028 0.88 ERN1 (0.32) ALDH1A1SMN1; SMN2KIF11
SCHEMBL48658 0.83 CES2 (0.42) ALDH1A1SMN1; SMN2KIF11CES2CES1
SCHEMBL24981909 0.78 ERN1 (0.44) ALDH1A1SMN1; SMN2
SCHEMBL23769421 0.78 SRC (0.39) ALDH1A1
SCHEMBL16584916 0.78 ALDH1A1 (0.38) ALDH1A1SMN1; SMN2KIF11
SCHEMBL18002614 0.73 KDM4E (0.46) ALDH1A1SMN1; SMN2CES2CES1
SCHEMBL19125728 0.73 SRC (0.41) ALDH1A1SMN1; SMN2KIF11
SCHEMBL19748916 0.73 ALDH1A1 (0.35) ALDH1A1SMN1; SMN2KIF11CES2CES1
SCHEMBL1613502 0.73 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2KIF11
SCHEMBL19136810 0.73 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2KIF11

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-4180436-A1 TRICYCLIC PYRIMIDINONE COMPOUND, PREPARATION METHOD THEREFOR, AND COMPOSITION AND USE THEREOF Neusco Biotech Limited (CN) 2023-05-17 EP disclosed
EP-4174070-A1 TRICYCLIC PYRIMIDINONE COMPOUND, PREPARATION METHOD THEREFOR, AND COMPOSITION AND USE THEREOF Neusco Biotech Limited (CN) 2023-05-03 EP disclosed