SCHEMBL9050331

SCHEMBL9050331

CCc1c(Cl)ccc2c1c(=O)n(CC(=O)O)c(=O)n2Cc1ccc(F)cc1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 5/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
CCR2 P41597 2/20 0.41
ALDH1A1 P00352 1/20 0.41
TP53 P04637 1/20 0.40
AKR1B10 O60218 1/20 0.39
AKR1B1 P15121 1/20 0.39

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
SCHEMBL9057868 0.91 KMT2A (0.49) PTGDR2KMT2AMEN1CCR2ALDH1A1
SCHEMBL9047414 0.82 LMNA (0.47) KMT2ACCR2
SCHEMBL9046149 0.82 AKR1B1 (0.59) KMT2AMEN1AKR1B10AKR1B1
SCHEMBL9050224 0.80 LMNA (0.42) KMT2AMEN1CCR2
SCHEMBL9049803 0.75 HDAC1 (0.53) PTGDR2KMT2ATP53AKR1B1
SCHEMBL9049508 0.74 LMNA (0.43) CCR2
SCHEMBL9484457 0.74 KMT2A (0.48) PTGDR2KMT2AMEN1CCR2AKR1B10
SCHEMBL9046879 0.72 AKR1B1 (0.55) AKR1B10AKR1B1
SCHEMBL9047460 0.71 MEN1 (0.50) PTGDR2KMT2AMEN1ALDH1A1TP53
SCHEMBL9049601 0.67 LMNA (0.49) PTGDR2CCR2

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-0456835-B1 QUINAZOLINE-3-ALKANOIC ACID DERIVATIVE, SALT THEREOF, AND PRODUCTION THEREOF KYORIN SEIYAKU KK (JP) 1996-05-15 EP disclosed
EP-0456835-A1 QUINAZOLINE-3-ALKANOIC ACID DERIVATIVE, SALT THEREOF, AND PRODUCTION THEREOF KYORIN PHARMACEUTICAL CO., LTD. (JP) 1991-11-21 EP disclosed