SCHEMBL28958798

SCHEMBL28958798

O=C(ONCI)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.55
KMT2A Q03164 5/20 0.55
MAPT P10636 4/20 0.55
POLB P06746 1/20 0.55
TSHR P16473 4/20 0.52
LMNA P02545 2/20 0.50
F2 P00734 1/20 0.50
TDP1 Q9NUW8 4/20 0.47
MAPK1 P28482 2/20 0.46
HIF1A Q16665 1/20 0.46
SLC6A2 P23975 1/20 0.46
SLC6A3 Q01959 1/20 0.46
SMN1; SMN2 Q16637 4/20 0.45
HPGD P15428 2/20 0.45
KDM4E B2RXH2 2/20 0.45
MEN1 O00255 1/20 0.45
CYP3A4 P08684 1/20 0.45
ALOX15 P16050 1/20 0.45
CES1 P23141 1/20 0.45
PKM P14618 1/20 0.45

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
SCHEMBL10061827 0.82 KMT2A (0.57) ALDH1A1KMT2AMAPTPOLBTSHR
SCHEMBL3492756 0.80 TSHR (0.57) ALDH1A1KMT2AMAPTPOLBTSHR
SCHEMBL20415330 0.80 KMT2A (0.55) ALDH1A1KMT2AMAPTPOLBTSHR
SCHEMBL27954014 0.78 ALDH1A1 (0.53) ALDH1A1KMT2AMAPTPOLBTSHR
SCHEMBL10904247 0.78 KMT2A (0.53) ALDH1A1KMT2AMAPTPOLBTSHR
SCHEMBL27419910 0.78 ALDH1A1 (0.53) ALDH1A1KMT2AMAPTPOLBTSHR
SCHEMBL3986708 0.77 KMT2A (0.61) ALDH1A1KMT2AMAPTPOLBTSHR
Hydrochloric Acid SCHEMBL10904248 0.77 KMT2A (0.52) ALDH1A1KMT2AMAPTPOLBTSHR
SCHEMBL1833943 0.77 LMNA (0.55) ALDH1A1KMT2AMAPTPOLBTSHR
Hydrochloric Acid SCHEMBL10905007 0.77 KMT2A (0.52) ALDH1A1KMT2AMAPTPOLBTSHR

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
CN-106749166-B Preparation and application of multi-iodine salt photoconductive material 南京工业大学 2020-03-20 CN disclosed