SCHEMBL3344376

SCHEMBL3344376

Cc1cc(OCC(=O)O)c2c(C)c(Cc3ccc(Cl)cc3)c(=O)n(Cc3ccccc3)c2c1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 9/20 0.55
PLA2G1B P04054 4/20 0.55
PLA2G10 O15496 3/20 0.55
PLA2G5 P39877 3/20 0.55
PLA2G2E Q9NZK7 3/20 0.55
P2RX3 P56373 3/20 0.42
TSHR P16473 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
PKM P14618 1/20 0.40
PTGDR2 Q9Y5Y4 2/20 0.40
PPARG P37231 2/20 0.40
ALOX5 P09917 1/20 0.39
LMNA P02545 1/20 0.39
HTT P42858 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
SCHEMBL3348857 0.91 PLA2G10 (0.46) PLA2G2APLA2G1BPLA2G10PLA2G5PLA2G2E
SCHEMBL3345462 0.89 PLA2G2A (0.45) PLA2G2APLA2G1BPLA2G10PLA2G5PLA2G2E
SCHEMBL6586773 0.86 PLA2G2A (0.49) PLA2G2APLA2G1BPLA2G10PLA2G5PLA2G2E
SCHEMBL3345066 0.86 TDP1 (0.43) PLA2G2APLA2G1BPLA2G10PLA2G5PLA2G2E
SCHEMBL3345114 0.85 PTGDR2 (0.53) PLA2G2APLA2G1BPLA2G10PLA2G5PLA2G2E
SCHEMBL3344022 0.83 PLA2G1B (0.49) PLA2G2APLA2G1BPLA2G10PLA2G5PLA2G2E
SCHEMBL3345534 0.82 KDM4E (0.44) PLA2G2AP2RX3TSHRPKMPTGDR2
SCHEMBL3409928 0.81 ALDH1A1 (0.40) PLA2G2APLA2G1BPLA2G10PLA2G5PLA2G2E
SCHEMBL3346068 0.81 TDP1 (0.43) PLA2G2APLA2G1BPLA2G10PLA2G5PLA2G2E
SCHEMBL3348093 0.80 PLA2G2A (0.45) PLA2G2APLA2G1BPLA2G10PLA2G5PLA2G2E

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010040989-A1 QUINOLIN-2-ONE COMPOUNDS ARGENTA ORAL THERAPEUTICS LIMITED (GB) 2010-04-15 WO claimed
WO-2010040989-A1 QUINOLIN-2-ONE COMPOUNDS ARGENTA ORAL THERAPEUTICS LIMITED (GB) 2010-04-15 WO disclosed
WO-2010040989-A1 QUINOLIN-2-ONE COMPOUNDS ARGENTA ORAL THERAPEUTICS LIMITED (GB) 2010-04-15 WO disclosed