SCHEMBL28058086

SCHEMBL28058086

C=CCNc1cccc2cc3ccccc3cc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.46
KDM4E B2RXH2 7/20 0.46
GAA P10253 6/20 0.46
SMN1; SMN2 Q16637 5/20 0.46
MAPT P10636 5/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
ALOX12 P18054 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
CA12 O43570 1/20 0.39
CA3 P07451 1/20 0.39
CA4 P22748 1/20 0.39
CA6 P23280 1/20 0.39
CA5A P35218 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39
CA14 Q9ULX7 1/20 0.39
CA5B Q9Y2D0 1/20 0.39
CCNA2 P20248 1/20 0.38
CDK2 P24941 1/20 0.38

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
SCHEMBL896623 0.84 KMT2A (0.59) ALDH1A1KDM4EGAASMN1; SMN2MAPT
SCHEMBL31497264 0.84 KMT2A (0.59) ALDH1A1KDM4EGAASMN1; SMN2MAPT
SCHEMBL10865574 0.82 KMT2A (0.47) ALDH1A1KDM4EGAASMN1; SMN2MAPT
SCHEMBL9157046 0.79 KMT2A (0.45) ALDH1A1KDM4EGAASMN1; SMN2MAPT
SCHEMBL461067 0.78 KMT2A (0.50) ALDH1A1KDM4EGAASMN1; SMN2MAPT
SCHEMBL4784858 0.77 ALDH1A1 (0.44) ALDH1A1KDM4EGAASMN1; SMN2MAPT
SCHEMBL28147807 0.77 ALDH1A1 (0.50) ALDH1A1KDM4EGAASMN1; SMN2MAPT
SCHEMBL8944898 0.76 KMT2A (0.42) ALDH1A1KDM4EGAASMN1; SMN2MAPT
Styrene SCHEMBL10628559 0.75 MAPT (0.40) ALDH1A1KDM4EGAASMN1; SMN2MAPT
SCHEMBL8600443 0.74 KDM4E (0.61) ALDH1A1KDM4EGAASMN1; SMN2MAPT

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-105392846-A Electroconductive composition, electrical conductor, laminate and method for producing same, electroconductive film, and solid electrolyte capacitor MITSUBISHI RAYON CO 2016-03-09 CN disclosed