SCHEMBL9501955

SCHEMBL9501955

O=C(O)c1c(O)c(-c2ccc(Cl)cc2)nc2ccccc12

nearest known ligand 0.81

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 18/20 0.81
PDE10A Q9Y233 1/20 0.80
CYP3A4 P08684 2/20 0.68
CYP2C8 P10632 2/20 0.68
CYP2C9 P11712 2/20 0.68
CYP1A2 P05177 1/20 0.59
CYP2D6 P10635 1/20 0.59
CYP2A6 P11509 1/20 0.59
CYP2C19 P33261 1/20 0.59
LMNA P02545 1/20 0.57
SELPLG Q14242 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
SCHEMBL9501979 0.89 DHODH (1.00) DHODHPDE10ACYP3A4CYP2C8CYP2C9
Oxycinchophen SCHEMBL29460357 0.89 DHODH (1.00) DHODHPDE10ACYP3A4CYP2C8CYP2C9
Oxycinchophen SCHEMBL31654029 0.89 DHODH (1.00) DHODHPDE10ACYP3A4CYP2C8CYP2C9
Oxycinchophen SCHEMBL1170683 0.89 DHODH (1.00) DHODHPDE10ACYP3A4CYP2C8CYP2C9
SCHEMBL8793224 0.85 DHODH (0.58) DHODHPDE10ACYP3A4CYP2C8CYP2C9
SCHEMBL9505280 0.85 DHODH (0.81) DHODHPDE10ACYP2D6CYP2C19LMNA
SCHEMBL9502241 0.85 DHODH (0.82) DHODHPDE10ACYP3A4CYP2C8CYP2C9
SCHEMBL9502018 0.85 DHODH (0.81) DHODHPDE10ACYP3A4CYP2C8CYP2C9
SCHEMBL24122621 0.84 LMNA (0.83) DHODHPDE10ACYP3A4CYP2C8CYP2C9
SCHEMBL30299429 0.84 LMNA (0.83) DHODHPDE10ACYP3A4CYP2C8CYP2C9

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