SCHEMBL6982357

SCHEMBL6982357

Cc1nc2c(C)c(C(=O)c3cnn(C)c3O)ccc2s1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 1/20 0.37
NPC1 O15118 5/20 0.34
RAB9A P51151 5/20 0.34
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
MAPT P10636 9/20 0.34
SMN1; SMN2 Q16637 4/20 0.34
HPGD P15428 1/20 0.33
HTT P42858 2/20 0.32
ALDH1A1 P00352 2/20 0.32
BLM P54132 1/20 0.32
LMNA P02545 2/20 0.32
RECQL P46063 2/20 0.32
PPARG P37231 1/20 0.32
NCOA2 Q15596 1/20 0.32
NCOA1 Q15788 1/20 0.32
NCOA3 Q9Y6Q9 1/20 0.32
MALT1 Q9UDY8 1/20 0.31
GAA P10253 1/20 0.30
KDM4E B2RXH2 1/20 0.30

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
SCHEMBL6983756 0.88 MAPT (0.36) MGLLNPC1RAB9AMEN1KMT2A
SCHEMBL7088309 0.86 MAPT (0.39) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL6974905 0.84 MGLL (0.36) MGLLNPC1RAB9AMEN1KMT2A
SCHEMBL7157976 0.83 MAPT (0.32) NPC1RAB9AMAPTSMN1; SMN2ALDH1A1
SCHEMBL6979923 0.80 MALT1 (0.33) MALT1
SCHEMBL6979351 0.80
SCHEMBL27941481 0.74 SMN1; SMN2 (0.38) NPC1RAB9AMAPTSMN1; SMN2HPGD
SCHEMBL6984186 0.71 GAA (0.34) GAA
SCHEMBL12602531 0.70 SMN1; SMN2 (0.32) NPC1RAB9AMAPTSMN1; SMN2HTT
SCHEMBL9779245 0.69 GABRP (0.34) NPC1RAB9AMAPTSMN1; SMN2HTT

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
EP-1177194-B1 4-(3',4'-HETEROCYCLYL BENZOYL) PYRAZOLES AS HERBICIDAL AGENTS BASF AG (DE) 2003-09-17 EP disclosed
US-6541423-B1 Controlling vegatation BASF AKTIENGESELLSCHAFT (DE) 2003-04-01 US disclosed