SCHEMBL29290337

SCHEMBL29290337

O=C(O)c1c(F)c(-c2ccccc2)nc2ccccc12

nearest known ligand 0.69

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 12/20 0.69
PDE10A Q9Y233 4/20 0.69
LMNA P02545 2/20 0.69
TSHR P16473 1/20 0.67
CYP2D6 P10635 1/20 0.61
CYP2C19 P33261 1/20 0.61
TACR3 P29371 1/20 0.57
POLB P06746 1/20 0.52

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
SCHEMBL7692816 0.87 DHODH (0.56) DHODHPDE10ALMNATSHRCYP2D6
SCHEMBL17594286 0.83 PTGFR (0.65) DHODH
Oxycinchophen SCHEMBL1170683 0.81 DHODH (1.00) DHODHPDE10ALMNATSHRCYP2D6
SCHEMBL3908668 0.81 DHODH (0.71) DHODHPDE10ALMNATSHRCYP2D6
Oxycinchophen SCHEMBL31654029 0.81 DHODH (1.00) DHODHPDE10ALMNATSHRCYP2D6
SCHEMBL24122754 0.81 LMNA (1.00) DHODHPDE10ALMNATSHRCYP2D6
Oxycinchophen SCHEMBL29460357 0.81 DHODH (1.00) DHODHPDE10ALMNATSHRCYP2D6
SCHEMBL1581468 0.80 PDE10A (1.00) DHODHPDE10ALMNATSHRCYP2D6
SCHEMBL13815999 0.80 DHODH (0.69) DHODHPDE10ALMNATSHRCYP2D6
SCHEMBL13958023 0.80 DHODH (0.69) DHODHPDE10ALMNATSHRCYP2D6

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
CN-113613730-A Quinoline carboxamide derivative and process for producing intermediate for producing same 株式会社益力多本社 2021-11-05 CN disclosed