SCHEMBL9634152

SCHEMBL9634152

CCCCCOC(=O)Nc1ncncn1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.50
EPHX1 P07099 1/20 0.49
ALDH1A1 P00352 3/20 0.48
RAB9A P51151 5/20 0.48
NPC1 O15118 4/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
CASP1 P29466 1/20 0.48
CSNK2A2 P19784 2/20 0.47
CSNK2A1 P68400 2/20 0.47
TSHR P16473 1/20 0.46
GAA P10253 1/20 0.45
HPGD P15428 3/20 0.44
KDM4E B2RXH2 2/20 0.44
MAPT P10636 1/20 0.44
MAPK1 P28482 1/20 0.44
MCL1 Q07820 1/20 0.44
ACHE P22303 6/20 0.44
PKM P14618 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
SCHEMBL996720 0.95 L3MBTL1 (0.55) L3MBTL1ALDH1A1RAB9ANPC1SMN1; SMN2
SCHEMBL4422292 0.88 RAB9A (0.41) L3MBTL1ALDH1A1RAB9ANPC1SMN1; SMN2
SCHEMBL6657424 0.82 ALDH1A1 (0.46) ALDH1A1RAB9ANPC1SMN1; SMN2TSHR
SCHEMBL15348811 0.81 GAA (0.64) L3MBTL1ALDH1A1RAB9ANPC1SMN1; SMN2
SCHEMBL3368672 0.80 EPHX1 (0.59) L3MBTL1EPHX1ALDH1A1RAB9ACSNK2A2
SCHEMBL6256084 0.79 RAB9A (0.52) L3MBTL1ALDH1A1RAB9ANPC1SMN1; SMN2
SCHEMBL6578768 0.78 RAB9A (0.51) L3MBTL1ALDH1A1RAB9ANPC1SMN1; SMN2
SCHEMBL6270005 0.78 RAB9A (0.51) L3MBTL1ALDH1A1RAB9ANPC1SMN1; SMN2
SCHEMBL994563 0.76 RAB9A (0.55) L3MBTL1EPHX1ALDH1A1RAB9ANPC1
SCHEMBL3368234 0.76 EPHX1 (0.54) L3MBTL1EPHX1ALDH1A1RAB9ANPC1

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
US-5096484-A SULPHONYLUREA-TYPE HERBICIDES RHONE-POULENC AGROCHIMIE (FR) 1992-03-17 US disclosed
US-4960454-A Sulphonylurea-type herbicides RHONE-POULENC AGROCHIMIE (FR) 1990-10-02 US disclosed