SCHEMBL12974528

SCHEMBL12974528

C=Cc1c(NCc2ccco2)cc(-c2ccc(I)c(N(C)C)c2F)nc1C

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.34
▸ MAPK1 P28482 5/20 0.34
▸ HSD17B10 Q99714 4/20 0.34
▸ TSHR P16473 3/20 0.34
▸ KDM4E B2RXH2 3/20 0.34
▸ USP2 O75604 1/20 0.34
▸ ALOX15 P16050 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ KMT2A Q03164 2/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ PKM P14618 1/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ F2RL1 P55085 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ CRHBP P24387 1/20 0.32
▸ CRHR2 Q13324 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ KCNH3 Q9ULD8 1/20 0.31

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
SCHEMBL2139169 0.76 APP (0.42) MAPTMAPK1HSD17B10TSHRKDM4E
SCHEMBL2140353 0.68 APP (0.43) MAPTMAPK1HSD17B10TSHRKDM4E
SCHEMBL2136110 0.67 APP (0.43) MAPTMAPK1HSD17B10TSHRKDM4E
SCHEMBL10285911 0.65 — —
SCHEMBL10087223 0.65 ALDH1A1 (0.37) MAPTMAPK1HSD17B10TSHRKDM4E
SCHEMBL2139176 0.61 APP (0.40) MAPTMAPK1HSD17B10TSHRKDM4E
SCHEMBL10206317 0.61 APP (0.45) MAPTMAPK1HSD17B10TSHRKDM4E
SCHEMBL2136872 0.59 APP (0.50) MAPTMAPK1TSHRKDM4EUSP2
SCHEMBL2141122 0.59 ALDH1A1 (0.48) MAPTHSD17B10TSHRKDM4EKMT2A
SCHEMBL14869577 0.57 MAPT (0.58) MAPTMAPK1HSD17B10TSHRKDM4E

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
WO-2010149956-A1 4 -AMINOPICOLINATES AND THEIR USE AS HERBICIDES SYNGENTA LIMITED (GB) 2010-12-29 — — WO disclosed
Send feedback