SCHEMBL2788935

SCHEMBL2788935

NN=C(Cc1ccc(F)cc1)c1ccncc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.46
LTA4H P09960 1/20 0.44
ALDH1A1 P00352 2/20 0.43
KDM4E B2RXH2 1/20 0.43
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
TAAR1 Q96RJ0 1/20 0.41
PTGS2 P35354 1/20 0.39
LMNA P02545 2/20 0.38
GAA P10253 2/20 0.38
HTT P42858 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
TSHR P16473 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
MAPK1 P28482 1/20 0.37
PRKACA P17612 1/20 0.37
ROCK1 Q13464 1/20 0.37
MAPT P10636 1/20 0.37
USP2 O75604 1/20 0.37
RAB9A P51151 1/20 0.37

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
SCHEMBL5095734 0.85 L3MBTL1 (0.47) L3MBTL1LTA4HALDH1A1KDM4EKMT2A
SCHEMBL4459267 0.85 L3MBTL1 (0.47) L3MBTL1LTA4HALDH1A1KDM4EKMT2A
SCHEMBL4459265 0.85 L3MBTL1 (0.47) L3MBTL1LTA4HALDH1A1KDM4EKMT2A
SCHEMBL9768868 0.83 GAA (0.49) ALDH1A1KMT2AMEN1GAAHTT
SCHEMBL9419947 0.81 PAX8 (0.49) KMT2AMEN1TAAR1LMNAMAPT
SCHEMBL23410797 0.78 SMN1; SMN2 (0.47) L3MBTL1LTA4HALDH1A1KDM4EKMT2A
SCHEMBL6091876 0.78 SMN1; SMN2 (0.47) L3MBTL1LTA4HALDH1A1KDM4EKMT2A
SCHEMBL6091878 0.78 SMN1; SMN2 (0.47) L3MBTL1LTA4HALDH1A1KDM4EKMT2A
SCHEMBL2788948 0.77 KDM4E (0.48) L3MBTL1LTA4HALDH1A1KDM4EKMT2A
SCHEMBL13713105 0.74 L3MBTL1 (0.50) L3MBTL1LTA4HALDH1A1KDM4EKMT2A

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-2010046215-A2 DIAZA-INDOLE DERIVATIVES AND THEIR USE AS FUNGICIDES SYNGENTA PARTICIPATIONS AG (CH) 2010-04-29 WO disclosed