SCHEMBL11239658

SCHEMBL11239658

C=CCOC(=O)C(C#N)=Cc1ccc([N+](=O)[O-])o1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 7/20 0.53
KMT2A Q03164 7/20 0.53
MAPT P10636 6/20 0.53
POLB P06746 6/20 0.53
MEN1 O00255 5/20 0.53
KDM4E B2RXH2 4/20 0.53
ALDH1A1 P00352 4/20 0.53
L3MBTL1 Q9Y468 3/20 0.53
THRB P10828 2/20 0.53
HSP90AA1 P07900 1/20 0.53
HTT P42858 1/20 0.53
NPC1 O15118 3/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
NPSR1 Q6W5P4 2/20 0.53
GAA P10253 2/20 0.53
MITF O75030 1/20 0.53
RECQL P46063 1/20 0.53
PKM P14618 1/20 0.50
CCR6 P51684 1/20 0.50
NLRP1 Q9C000 1/20 0.50

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
SCHEMBL11239640 1.00 LMNA (0.53) LMNAKMT2AMAPTPOLBMEN1
SCHEMBL11236031 0.86 ALDH1A1 (0.62) LMNAKMT2AMAPTPOLBMEN1
SCHEMBL11236035 0.86 ALDH1A1 (0.62) LMNAKMT2AMAPTPOLBMEN1
SCHEMBL11282631 0.84 GLO1 (0.58) LMNAKMT2AMAPTPOLBMEN1
SCHEMBL11226788 0.84 LMNA (0.60) LMNAKMT2AMAPTPOLBMEN1
SCHEMBL11226785 0.84 LMNA (0.60) LMNAKMT2AMAPTPOLBMEN1
SCHEMBL11227796 0.82 POLB (0.61) LMNAKMT2AMAPTPOLBMEN1
SCHEMBL11227799 0.82 POLB (0.61) LMNAKMT2AMAPTPOLBMEN1
SCHEMBL9456431 0.79 KMT2A (0.62) LMNAKMT2AMAPTPOLBMEN1
SCHEMBL10512176 0.79 KMT2A (0.62) LMNAKMT2AMAPTPOLBMEN1

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-4358521-A ELECTROGRAPHY FUJI PHOTO FILM CO., LTD. (JP) 1982-11-09 US disclosed