SCHEMBL7464813

SCHEMBL7464813

Fc1ccc(Cc2ccnc3cc(Cl)ccc23)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 2/20 0.53
SOS2 Q07890 1/20 0.53
CYP1A2 P05177 2/20 0.48
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.47
CCR1 P32246 1/20 0.46
PKM P14618 2/20 0.45
FERMT2 Q96AC1 2/20 0.43
MAPT P10636 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
ALOX15 P16050 1/20 0.42
CASP1 P29466 1/20 0.42
HSD17B10 Q99714 1/20 0.42
CYP2C8 P10632 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
KDM4E B2RXH2 1/20 0.42
PRNP P04156 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42

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
SCHEMBL12510657 0.82 AXL (0.53)
SCHEMBL13186225 0.79 MAOB (0.37) NR4A2SOS2CYP1A2KMT2AMEN1
SCHEMBL7497346 0.77 HTR2C (0.48) NR4A2SOS2CYP1A2KMT2AMEN1
SCHEMBL15673284 0.77 PKM (0.76) NR4A2CYP1A2KMT2AMEN1CCR1
SCHEMBL11808225 0.76 STAT1 (0.57) NR4A2SOS2CYP1A2KMT2AMEN1
SCHEMBL4509324 0.75 TLR8 (0.59) NR4A2SOS2CYP1A2KMT2ACCR1
SCHEMBL8066565 0.74 NR4A2 (0.58) NR4A2SOS2CYP1A2KMT2ACCR1
SCHEMBL8367161 0.74 NR4A2 (0.58) NR4A2SOS2CYP1A2KMT2ACCR1
SCHEMBL4355081 0.73 NR4A2 (0.61) NR4A2SOS2CYP1A2KMT2AMEN1
SCHEMBL5591919 0.72 NR4A2 (0.49) NR4A2SOS2CYP1A2KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0326330-B1 Quinoline fungicides DOW AGROSCIENCES LLC (US) 2002-07-24 EP disclosed
CN-1031263-C Quinoline, quinazoline, and cinnoline LILLY CO ELI (US) 1996-03-13 CN disclosed
US-5240940-A Synergistic nmixture DOWELANCO (US) 1993-08-31 US disclosed
US-5145843-A For plants DOWELANCO (US) 1992-09-08 US disclosed
CN-1034925-A Quinoline, quinazoline and cinnoline LILLY CO ELI (US) 1989-08-23 CN disclosed
EP-0326330-A2 Quinoline, quinazoline, and cinnoline fungicides DowElanco (US) 1989-08-02 EP disclosed