SCHEMBL9484457

SCHEMBL9484457

CCc1cccc2c1c(=O)n(CC(=O)O)c(=O)n2Cc1ccc(Cl)cc1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.48
MEN1 O00255 2/20 0.48
PTGDR2 Q9Y5Y4 4/20 0.44
AKR1B1 P15121 1/20 0.44
APEX1 P27695 1/20 0.43
CCR2 P41597 1/20 0.43
CMA1 P23946 3/20 0.42
AKR1B10 O60218 1/20 0.41
MAPT P10636 1/20 0.41
CNR2 P34972 1/20 0.41

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
SCHEMBL9048106 0.87 MEN1 (0.55) KMT2AMEN1PTGDR2AKR1B1APEX1
SCHEMBL9057868 0.83 KMT2A (0.49) KMT2AMEN1PTGDR2AKR1B1CCR2
SCHEMBL11263079 0.80 APEX1 (0.70) KMT2AMEN1PTGDR2APEX1CCR2
SCHEMBL9049601 0.78 LMNA (0.49) PTGDR2CCR2MAPT
SCHEMBL9048800 0.76 LMNA (0.51) KMT2AMEN1PTGDR2AKR1B1APEX1
SCHEMBL10487926 0.74 MEN1 (0.61) KMT2AMEN1APEX1MAPT
SCHEMBL9050331 0.74 PTGDR2 (0.42) KMT2AMEN1PTGDR2AKR1B1CCR2
SCHEMBL11260208 0.73 APEX1 (0.50) KMT2AMEN1AKR1B1APEX1CCR2
SCHEMBL9050224 0.72 LMNA (0.42) KMT2AMEN1CCR2MAPT
SCHEMBL9047414 0.72 LMNA (0.47) KMT2ACCR2MAPT

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
US-5234928-A Inhibit platelet aggregation KYORIN PHARMACEUTICAL CO., LTD. (JP) 1993-08-10 US disclosed
EP-0456835-A1 QUINAZOLINE-3-ALKANOIC ACID DERIVATIVE, SALT THEREOF, AND PRODUCTION THEREOF KYORIN PHARMACEUTICAL CO., LTD. (JP) 1991-11-21 EP disclosed