SCHEMBL9215323

SCHEMBL9215323

O=C(O)C1C=CC=C(Cl)C1(Cl)C(=O)O

nearest known ligand 0.31

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.31
TP53 P04637 1/20 0.31
ALOX15 P16050 1/20 0.31
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HSD17B10 Q99714 1/20 0.31
TSHR P16473 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL23888600 0.79 ALDH1A1 (0.31) ALDH1A1TP53ALOX15MAPK1SMN1; SMN2
SCHEMBL5279252 0.78 ALDH1A1 (0.31) ALDH1A1TP53ALOX15MAPK1SMN1; SMN2
SCHEMBL14483611 0.75
SCHEMBL8763016 0.74
SCHEMBL29198552 0.68
SCHEMBL30708138 0.67
SCHEMBL6019196 0.66 S1PR1 (0.31)
SCHEMBL27599690 0.66 TSHR (0.30) MAPK1HSD17B10TSHRTDP1
SCHEMBL9687455 0.63
SCHEMBL30917366 0.63

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-1995000576-A1 NOVEL PHTHALIMIDES AND REVERSIBLY CROSSLINKED IMIDE POLYMERS AKZO NOBEL N.V. (NL) 1995-01-05 WO disclosed