SCHEMBL13680497

SCHEMBL13680497

Cc1cccc(-c2ccc(NC(N)=O)cc2)c1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 6/20 0.69
CSF1R P07333 1/20 0.62
FLT1 P17948 1/20 0.62
FLT3 P36888 1/20 0.62
CNR1 P21554 2/20 0.56
KMT2A Q03164 1/20 0.51
HSD17B1 P14061 1/20 0.50
HSD17B2 P37059 1/20 0.50
HDAC2 Q92769 1/20 0.49
AKT2 P31751 1/20 0.48
FNTA P49354 1/20 0.48
FNTB P49356 1/20 0.48
DHODH Q02127 1/20 0.48
GAA P10253 1/20 0.47
MAPT P10636 1/20 0.47
GFER P55789 1/20 0.47
PEPD P12955 1/20 0.47
PSEN1 P49768 1/20 0.47
PSEN2 P49810 1/20 0.47
APH1B Q8WW43 1/20 0.47

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
SCHEMBL13680547 0.88 CNR1 (0.61) KIF11CSF1RFLT1FLT3CNR1
SCHEMBL8265472 0.85 HSD17B10 (0.66) CSF1RFLT1FLT3CNR1KMT2A
SCHEMBL27524136 0.84 KIF11 (0.76) KIF11KMT2AGAAMAPTGFER
SCHEMBL13749770 0.83 KIF11 (0.69) KIF11CSF1RFLT1FLT3CNR1
SCHEMBL13680643 0.83 CYP1A2 (0.67) KIF11CSF1RFLT1FLT3CNR1
SCHEMBL5428805 0.82 KIF11 (1.00) KIF11GAAMAPTGFERPEPD
SCHEMBL13680466 0.82 FAAH (0.56) CSF1RFLT1FLT3CNR1KMT2A
SCHEMBL13680444 0.82 CNR1 (0.62) CSF1RFLT1FLT3CNR1KMT2A
SCHEMBL13680447 0.81 PNPLA2 (0.62) CSF1RFLT1FLT3CNR1KMT2A
SCHEMBL166848 0.80 HSD17B10 (0.69) KMT2AGAARAB9A

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-7582658-B2 Bicyclic compound ASAHI KASEI PHARMA CORPORATION (JP) 2009-09-01 US disclosed
US-7582658-B2 Bicyclic compound ASAHI KASEI PHARMA CORPORATION (JP) 2009-09-01 US disclosed