SCHEMBL3861623

SCHEMBL3861623

CC1=CC(=Nc2c(C)n(C)n(-c3ccccc3)c2=O)C(N)=CC1=[N+](C)C

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 11/20 0.56
▸ GAA P10253 7/20 0.56
▸ MPI P34949 3/20 0.56
▸ HTT P42858 3/20 0.56
▸ LMNA P02545 3/20 0.56
▸ ALDH1A1 P00352 9/20 0.53
▸ MAPK1 P28482 5/20 0.53
▸ MEN1 O00255 4/20 0.53
▸ KMT2A Q03164 4/20 0.53
▸ KDM4E B2RXH2 3/20 0.53
▸ POLB P06746 3/20 0.53
▸ THRB P10828 2/20 0.53
▸ ATM Q13315 1/20 0.53
▸ MITF O75030 1/20 0.53
▸ NSD2 O96028 1/20 0.53
▸ OPRK1 P41145 1/20 0.53
▸ NPSR1 Q6W5P4 1/20 0.53
▸ TDP1 Q9NUW8 2/20 0.51
▸ TP53 P04637 1/20 0.51
▸ HSP90AA1 P07900 1/20 0.51

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
SCHEMBL3861621 1.00 MAPT (0.56) MAPTGAAMPIHTTLMNA
Perchlorate SCHEMBL4116875 0.96 MAPT (0.52) MAPTGAAMPIHTTLMNA
SCHEMBL13964132 0.86 MAPT (0.58) MAPTGAAMPIHTTLMNA
SCHEMBL3859871 0.85 MAPT (0.59) MAPTGAAMPIHTTLMNA
SCHEMBL3859873 0.85 MAPT (0.59) MAPTGAAMPIHTTLMNA
SCHEMBL3932865 0.82 MAPT (0.58) MAPTGAAMPIHTTLMNA
SCHEMBL3932868 0.82 MAPT (0.58) MAPTGAAMPIHTTLMNA
SCHEMBL13963965 0.82 MAPT (0.58) MAPTGAAMPIHTTLMNA
Perchlorate SCHEMBL3863336 0.80 MAPT (0.53) MAPTGAAMPIHTTLMNA
Perchlorate SCHEMBL3863334 0.80 MAPT (0.53) MAPTGAAMPIHTTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7582123-B2 Coloring composition comprising at least one azomethine compound with a pyrazolinone unit L'OREAL S.A. (FR) 2009-09-01 — — US disclosed
EP-2011787-A1 Dying composition comprising an azomethin-type compound with a pyrazolinone moiety L'Oreal (FR) 2009-01-07 — — EP disclosed
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