SCHEMBL5501980

SCHEMBL5501980

CSC(Cc1cccc(F)c1N)c1nc(C)cc(C)n1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
TDP1 Q9NUW8 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
CHRM4 P08173 2/20 0.33
LMNA P02545 1/20 0.33
PKM P14618 1/20 0.33
KDM4E B2RXH2 2/20 0.31
ALDH1A1 P00352 1/20 0.31
SLC6A2 P23975 1/20 0.30
GRM5 P41594 1/20 0.30
ADORA2A P29274 1/20 0.30
ADORA1 P30542 1/20 0.30
NOS3 P29474 1/20 0.30
NOS2 P35228 1/20 0.30
RAB9A P51151 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
SCHEMBL5502762 0.88 TDP1 (0.33) TDP1L3MBTL1ADORA1
SCHEMBL5498826 0.82 NPC1 (0.30) RAB9A
SCHEMBL2282271 0.74 MEN1 (0.35) KMT2AMEN1TDP1LMNAALDH1A1
SCHEMBL2290194 0.73 HTR6 (0.39) KMT2AMEN1TDP1L3MBTL1CHRM4
SCHEMBL5501978 0.72 KMT2A (0.36) KMT2AMEN1TDP1CHRM4KDM4E
SCHEMBL5501773 0.72 MEN1 (0.38) KMT2AMEN1TDP1L3MBTL1CHRM4
SCHEMBL2291781 0.71 KMT2A (0.37) KMT2AMEN1TDP1LMNAKDM4E
SCHEMBL2282195 0.69 KMT2A (0.35) KMT2AMEN1TDP1LMNAKDM4E
SCHEMBL2289428 0.69 KMT2A (0.35) KMT2AMEN1TDP1LMNAKDM4E
SCHEMBL5502210 0.69 CHRM4 (0.32) KMT2AMEN1CHRM4ADORA1

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-1773124-A1 A USE OF SULFONANILIDES AS AGRICULTURAL AND HORTICULTURAL FUNGICIDE Bayer CropScience Aktiengesellschaft (DE) 2007-04-18 EP disclosed
WO-2006008159-A1 A USE OF SULFONANILIDES AS AGRICULTURAL AND HORTICULTURAL FUNGICIDE BAYER CROPSCIENCE AG (DE) 2006-01-26 WO disclosed