SCHEMBL5325636

SCHEMBL5325636

CCOC(=O)c1cnc2ccc(C(=O)OC)cc2c1Nc1cccc(OC)c1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CREBBP Q92793 1/20 0.79
MAPT P10636 8/20 0.79
TP53 P04637 5/20 0.79
ALDH1A1 P00352 3/20 0.78
KDM4E B2RXH2 3/20 0.78
PKM P14618 1/20 0.78
PAX8 Q06710 1/20 0.71
LMNA P02545 1/20 0.67
POLB P06746 1/20 0.67
GAA P10253 1/20 0.63
PDE4B Q07343 1/20 0.62
NPSR1 Q6W5P4 2/20 0.62
HTT P42858 1/20 0.62
CLK1 P49759 1/20 0.62
SMN1; SMN2 Q16637 3/20 0.60
RXFP1 Q9HBX9 1/20 0.60
THRB P10828 1/20 0.60
AURKB Q96GD4 3/20 0.60
AURKA O14965 2/20 0.60
TSHR P16473 1/20 0.59

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
SCHEMBL31307791 0.92 TP53 (0.88) CREBBPMAPTTP53ALDH1A1KDM4E
SCHEMBL23494146 0.92 TP53 (0.88) CREBBPMAPTTP53ALDH1A1KDM4E
SCHEMBL31307824 0.92 MAPT (0.85) CREBBPMAPTTP53ALDH1A1KDM4E
SCHEMBL23493909 0.92 MAPT (0.85) CREBBPMAPTTP53ALDH1A1KDM4E
SCHEMBL3782313 0.92 MAPT (0.75) CREBBPMAPTTP53ALDH1A1KDM4E
SCHEMBL5455186 0.91 PDE4B (0.74) CREBBPMAPTTP53ALDH1A1KDM4E
SCHEMBL5329104 0.90 CREBBP (0.82) CREBBPMAPTTP53ALDH1A1KDM4E
SCHEMBL5322774 0.90 CREBBP (0.82) CREBBPMAPTTP53ALDH1A1KDM4E
SCHEMBL31307883 0.89 PAX8 (0.81) CREBBPMAPTTP53ALDH1A1KDM4E
SCHEMBL5327687 0.89 PAX8 (0.81) CREBBPMAPTTP53ALDH1A1KDM4E

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
WO-2007139496-A1 QUINOLINE DERIVATIVES ACTING AS TYROSINE KINASE INHIBITORS CLANOTECH AB (SE) 2007-12-06 WO disclosed