SCHEMBL6283770

SCHEMBL6283770

Cc1cccc(C(=O)Nc2cccc(On3nc(C=Cc4ccccc4)c4ccccc43)c2)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 5/20 0.59
FGFR1 P11362 2/20 0.59
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
GAA P10253 1/20 0.48
MAPT P10636 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
KCNK3 O14649 6/20 0.48
KCNK9 Q9NPC2 5/20 0.48
KMT2A Q03164 4/20 0.48
MEN1 O00255 3/20 0.48
POLB P06746 1/20 0.48
ELANE P08246 1/20 0.48
SNCA P37840 2/20 0.46
KCNH2 Q12809 1/20 0.46
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43

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
SCHEMBL6276176 0.86 KDR (0.55) KDRFGFR1MAPTKMT2AMEN1
SCHEMBL5250366 0.74 KDR (1.00) KDRFGFR1
SCHEMBL5250363 0.74 KDR (1.00) KDRFGFR1
SCHEMBL6496546 0.74 KDR (0.53) KDRFGFR1MAPTKCNK3KCNK9
SCHEMBL4249753 0.69 KCNK3 (0.92) CYP1A2CYP3A4GAAMAPTCYP2C9
SCHEMBL5879266 0.68 KDR (0.68) KDRFGFR1ELANESNCA
SCHEMBL5252223 0.68 KDR (0.68) KDRFGFR1ELANESNCA
SCHEMBL30608967 0.68 KCNK3 (0.87) MAPTKCNK3KCNK9KMT2AMEN1
SCHEMBL259666 0.68 KCNK3 (0.87) MAPTKCNK3KCNK9KMT2AMEN1
SCHEMBL23367931 0.68 CYP1A2 (0.78) CYP1A2CYP3A4GAAMAPTCYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6891044-B2 Indazole compounds and pharmaceutical compositions for Inhibiting protein kinases, and methods for their use AGOURON PHARMACEUTICALS, INC. (US) 2005-05-10 US disclosed