SCHEMBL27354565

SCHEMBL27354565

Nc1cccc(C(=O)NOC(=O)c2ccccc2)c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.71
MAPT P10636 3/20 0.71
KMT2A Q03164 2/20 0.71
POLB P06746 1/20 0.71
PBRM1 Q86U86 1/20 0.56
HDAC1 Q13547 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
HSD17B10 Q99714 1/20 0.49
KDM4C Q9H3R0 1/20 0.48
KDM4E B2RXH2 1/20 0.48
PTGS1 P23219 1/20 0.46
F2 P00734 2/20 0.44
PLG P00747 1/20 0.44
PRSS1 P07477 1/20 0.44
PRSS2 P07478 1/20 0.44
PRSS3 P35030 1/20 0.44
TSHR P16473 1/20 0.44
PRMT5 O14744 1/20 0.44
WDR77 Q9BQA1 1/20 0.44

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
SCHEMBL27802385 0.88 ALDH1A1 (0.73) ALDH1A1MAPTKMT2APOLBPBRM1
SCHEMBL5809526 0.84 ALDH1A1 (1.00) ALDH1A1MAPTKMT2APOLBHDAC1
SCHEMBL11146599 0.82 ALDH1A1 (0.96) ALDH1A1MAPTKMT2APOLBHDAC1
SCHEMBL24367636 0.81 ALDH1A1 (0.63) ALDH1A1MAPTKMT2APOLBPBRM1
SCHEMBL31145048 0.81 ALDH1A1 (0.63) ALDH1A1MAPTKMT2APOLBPBRM1
SCHEMBL27848550 0.81 KMT2A (0.67) ALDH1A1MAPTKMT2APOLBHDAC1
SCHEMBL27703794 0.80 ALDH1A1 (0.65) ALDH1A1MAPTKMT2APOLBHDAC1
SCHEMBL9701403 0.79 PBRM1 (0.63) ALDH1A1MAPTKMT2APOLBPBRM1
SCHEMBL28104455 0.78 KMT2A (0.73) ALDH1A1MAPTKMT2APOLBKDM4E
SCHEMBL11183467 0.77 ALDH1A1 (0.55) ALDH1A1MAPTKMT2APOLBPBRM1

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
CN-1073571-C Dialkyl tin compound of mononuclear aromatic heterocycle hydroxamate and its synthesis UNIV SHANXI (CN) 2001-10-24 CN disclosed
CN-1073566-C Binuclear aromatic, heterocyclic monoacyl hydroxamic acid dialkyl-tin compounds, and method for synthesizing same UNIV SHANXI (CN) 2001-10-24 CN disclosed