SCHEMBL11214950

SCHEMBL11214950

CC(CNc1ccc([N+](=O)[O-])cc1)N(C)C

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.57
ALDH1A1 P00352 7/20 0.49
SMN1; SMN2 Q16637 4/20 0.49
HTT P42858 3/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
HPGD P15428 1/20 0.49
RECQL P46063 1/20 0.49
HSD17B10 Q99714 1/20 0.49
GAA P10253 1/20 0.46
GLA P06280 2/20 0.46
PTPRF P10586 1/20 0.44
PTPN2 P17706 1/20 0.44
PTPN1 P18031 1/20 0.44
PTPN11 Q06124 1/20 0.44
POLB P06746 1/20 0.43
LMNA P02545 1/20 0.43
KDM4E B2RXH2 1/20 0.43

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
SCHEMBL8635097 0.83 MAPT (0.65) MAPTALDH1A1SMN1; SMN2HTTMEN1
Ammonia Solution, Strong SCHEMBL6701329 0.81 MAPT (0.62) MAPTALDH1A1SMN1; SMN2HTTMEN1
SCHEMBL9820267 0.80 MAPT (0.61) MAPTALDH1A1SMN1; SMN2HTTMEN1
SCHEMBL6563884 0.80 MAPT (0.61) MAPTALDH1A1SMN1; SMN2HTTMEN1
SCHEMBL30800484 0.80 MAPT (0.61) MAPTALDH1A1SMN1; SMN2HTTMEN1
SCHEMBL4616467 0.79 MAPT (0.59) MAPTALDH1A1SMN1; SMN2HTTMEN1
SCHEMBL5157176 0.76 MAPT (0.59) MAPTALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL3662904 0.76 MAPT (0.59) MAPTALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL9149907 0.75 ALDH1A1 (0.63) MAPTALDH1A1SMN1; SMN2HTTMEN1
SCHEMBL4332876 0.75 MAPT (0.54) MAPTALDH1A1SMN1; SMN2HTTMEN1

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
EP-0081790-A1 p-Phenylene diamines, their preparation and use Henkel Kommanditgesellschaft auf Aktien (DE) 1983-06-22 EP disclosed