SCHEMBL9502210

SCHEMBL9502210

O=C(O)c1c(O)c(-c2ccc(-c3ccccc3)cc2)nc2ccc(F)cc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 20/20 1.00
PDE10A Q9Y233 1/20 0.65
DHFR P00374 1/20 0.60
ALKBH5 Q6P6C2 1/20 0.60

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
SCHEMBL3894369 0.97 DHODH (0.95) DHODHPDE10ADHFRALKBH5
SCHEMBL10580105 0.93 DHODH (0.89) DHODHPDE10ADHFRALKBH5
SCHEMBL10582925 0.90 DHODH (1.00) DHODHPDE10A
SCHEMBL10583562 0.89 DHODH (1.00) DHODHPDE10ADHFRALKBH5
SCHEMBL10580409 0.89 DHODH (0.80) DHODHDHFRALKBH5
SCHEMBL10580016 0.89 DHODH (0.80) DHODHPDE10ADHFRALKBH5
SCHEMBL10582725 0.88 DHODH (1.00) DHODH
SCHEMBL8792419 0.86 DHODH (1.00) DHODHDHFRALKBH5
SCHEMBL9501973 0.86 DHODH (0.77) DHODH
SCHEMBL8732559 0.85 DHODH (1.00) DHODHDHFRALKBH5

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 6 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 claimed
US-4847381-A ANTIARTHRITIC AGENTS AMERICAN CYANAMID COMPANY (US) 1989-07-11 US claimed
EP-0305952-A1 Substituted 2-phenyl-4-quinoline-carboxylic acids AMERICAN CYANAMID COMPANY (US) 1989-03-08 EP claimed
EP-0305952-B1 SUBSTITUTED 2-PHENYL-4-QUINOLINE-CARBOXYLIC ACIDS AMERICAN CYANAMID COMPANY (US) 1993-06-02 EP disclosed
US-4847381-A ANTIARTHRITIC AGENTS AMERICAN CYANAMID COMPANY (US) 1989-07-11 US disclosed
EP-0305952-A1 Substituted 2-phenyl-4-quinoline-carboxylic acids AMERICAN CYANAMID COMPANY (US) 1989-03-08 EP disclosed