SCHEMBL9505820

SCHEMBL9505820

O=C(O)c1c(O)c(-c2ccc(I)cc2)nc2ccc(I)cc12

nearest known ligand 0.63

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 19/20 0.63
PDE10A Q9Y233 1/20 0.57

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
SCHEMBL9501983 0.92 DHODH (0.74) DHODHPDE10A
SCHEMBL9502003 0.92 DHODH (0.70) DHODHPDE10A
SCHEMBL10584241 0.90 DHODH (0.76) DHODHPDE10A
SCHEMBL9502018 0.85 DHODH (0.81) DHODHPDE10A
SCHEMBL27434750 0.81 DHODH (0.60) DHODH
SCHEMBL9501990 0.81 DHODH (0.84) DHODHPDE10A
SCHEMBL10580105 0.79 DHODH (0.89) DHODHPDE10A
SCHEMBL9502837 0.79 DHODH (0.85) DHODHPDE10A
SCHEMBL9502241 0.79 DHODH (0.82) DHODHPDE10A
SCHEMBL8792384 0.79 DHODH (0.72) DHODHPDE10A

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-0305952-B1 SUBSTITUTED 2-PHENYL-4-QUINOLINE-CARBOXYLIC ACIDS AMERICAN CYANAMID COMPANY (US) 1993-06-02 EP disclosed
EP-0305952-A1 Substituted 2-phenyl-4-quinoline-carboxylic acids AMERICAN CYANAMID COMPANY (US) 1989-03-08 EP disclosed