SCHEMBL28147013

SCHEMBL28147013

Nc1cc(Cl)c(Cl)cc1Nc1c[c]ccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 7/20 0.41
KDM4E B2RXH2 5/20 0.41
MAPT P10636 5/20 0.41
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
HTT P42858 2/20 0.41
LMNA P02545 2/20 0.41
HPGD P15428 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ALDH1A1 P00352 5/20 0.40
ALOX15 P16050 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
GFER P55789 2/20 0.35
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.33
THRB P10828 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL6388023 0.82 GAA (0.35) GAAKDM4EMAPTMEN1KMT2A
SCHEMBL8616801 0.79 GAA (0.61) GAAKDM4EMAPTMEN1KMT2A
SCHEMBL6383792 0.76 GAA (0.42) GAAKDM4EMAPTMEN1KMT2A
SCHEMBL27618345 0.76 MAPK14 (0.43) GAAKDM4EMAPTMEN1KMT2A
SCHEMBL7096883 0.76 MAPT (0.37) GAAKDM4EMAPTMEN1KMT2A
SCHEMBL7099283 0.76 MAPT (0.37) GAAKDM4EMAPTMEN1KMT2A
SCHEMBL7014092 0.76 BCL6 (0.36) GAAHTTLMNAALDH1A1ALOX15
SCHEMBL27599844 0.74 TSHR (0.35) GAAKDM4EMAPTMEN1KMT2A
SCHEMBL7090460 0.72 HSD17B10 (0.43) GAAKDM4EMAPTMEN1KMT2A
SCHEMBL6386915 0.71 MAPT (0.42) GAAKDM4EMAPTMEN1KMT2A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106771303-B One kind is for analyzing conveying device and its working method in heavy metal-polluted soil sample injector 徐州腾睿智能装备有限公司 2018-09-18 CN claimed
CN-106771303-A One kind is for analyzing conveying device and its method of work in heavy metal-polluted soil sample injector 徐州工程学院 2017-05-31 CN claimed
CN-106771303-B One kind is for analyzing conveying device and its working method in heavy metal-polluted soil sample injector 徐州腾睿智能装备有限公司 2018-09-18 CN disclosed
CN-106771303-A One kind is for analyzing conveying device and its method of work in heavy metal-polluted soil sample injector 徐州工程学院 2017-05-31 CN disclosed