SCHEMBL11216342

SCHEMBL11216342

Cc1ccccc1C(=O)N(C)N(C)C(=O)c1ccccc1C

nearest known ligand 0.66

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.59
TSHR P16473 2/20 0.51
MAPK1 P28482 1/20 0.51
HPGD P15428 2/20 0.47
ERCC5 P28715 1/20 0.46
FEN1 P39748 1/20 0.46
HTT P42858 1/20 0.44
MEN1 O00255 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.43
GAA P10253 2/20 0.43
ALDH1A1 P00352 1/20 0.43
TP53 P04637 1/20 0.43
MAPT P10636 1/20 0.43
MYC P01106 1/20 0.42

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
SCHEMBL354228 0.86 KMT2A (0.59) KMT2ATSHRMAPK1HPGDERCC5
SCHEMBL30037151 0.86 KMT2A (0.59) KMT2ATSHRMAPK1HPGDERCC5
SCHEMBL25568752 0.86 TSHR (0.50) KMT2ATSHRMAPK1HPGDERCC5
Hydrochloric Acid SCHEMBL1776796 0.84 KMT2A (0.58) KMT2ATSHRMAPK1HPGDERCC5
SCHEMBL3634403 0.84 KMT2A (0.58) KMT2ATSHRMAPK1HPGDERCC5
SCHEMBL9557556 0.83 KMT2A (0.49) KMT2ATSHRMAPK1HPGDERCC5
SCHEMBL6832097 0.83 KMT2A (0.56) KMT2ATSHRMAPK1HPGDERCC5
SCHEMBL11879792 0.81 KMT2A (0.64) KMT2ATSHRMAPK1HPGDERCC5
Hydrochloric Acid SCHEMBL11560303 0.81 KMT2A (0.54) KMT2ATSHRMAPK1HPGDERCC5
SCHEMBL15129254 0.80 KMT2A (0.53) KMT2ATSHRMAPK1HPGDERCC5

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
US-4386053-A IMPREGNATION OF SUBSTRATE WITH ORGANIC PEROXIDE, CHROMOGEN, BUFFER AND STABILIZER TERUMO CORPORATION (JP) 1983-05-31 US disclosed