SCHEMBL10429616

SCHEMBL10429616

O=C(NNc1ccccc1)OCc1ccc(Cl)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.59
MEN1 O00255 3/20 0.58
MAPT P10636 3/20 0.58
KMT2A Q03164 3/20 0.58
POLB P06746 2/20 0.58
P2RX7 Q99572 1/20 0.56
PTGS2 P35354 2/20 0.55
ALDH1A1 P00352 4/20 0.50
CYP1A2 P05177 2/20 0.50
CYP3A4 P08684 2/20 0.50
CYP2C19 P33261 2/20 0.50
CYP2C9 P11712 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
ALOX12 P18054 1/20 0.49
PPARA Q07869 2/20 0.48
P2RX4 Q99571 1/20 0.48
MGLL Q99685 1/20 0.48
KDM4E B2RXH2 1/20 0.47
TP53 P04637 1/20 0.47

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
SCHEMBL4908338 0.89 GAA (0.69) GAAMAPTKMT2APOLBP2RX7
SCHEMBL10494592 0.86 POLB (0.68) GAAMEN1MAPTKMT2APOLB
SCHEMBL2301055 0.83 GAA (0.55) GAAMEN1MAPTKMT2APOLB
SCHEMBL3795024 0.79 POLB (0.68) MEN1MAPTKMT2APOLBALDH1A1
SCHEMBL28071194 0.78 PLAU (0.64) MEN1KMT2ASMN1; SMN2
SCHEMBL31043626 0.78 POLB (0.61) MEN1MAPTKMT2APOLBALDH1A1
SCHEMBL8631957 0.76 MIF (0.51) MEN1MAPTKMT2APOLBPTGS2
SCHEMBL6647703 0.76 ALDH1A1 (0.60) MEN1MAPTKMT2APOLBALDH1A1
SCHEMBL10595799 0.76 POLB (0.73) MEN1MAPTKMT2APOLBALDH1A1
SCHEMBL2295789 0.75 CA12 (0.66) GAAKMT2APOLBP2RX7ALDH1A1

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
JP-2300157-A None JP disclosed
JP-H02300157-A BENZYLCARBAZATE DERIVATIVE AND GERMICIDE FOR AGRICULTURE AND HORTICULTURE CONTAINING SAME DERIVATIVE TOSOH CORP 1990-12-12 JP disclosed