SCHEMBL7665233

SCHEMBL7665233

NCC(=O)N(C1CCCCC1)C1CCCCC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
KMT2A Q03164 5/20 0.42
MEN1 O00255 4/20 0.42
TSHR P16473 3/20 0.41
MAPK1 P28482 2/20 0.41
POLB P06746 1/20 0.41
PHGDH O43175 1/20 0.40
LMNA P02545 3/20 0.40
HSD11B1 P28845 1/20 0.39
NPSR1 Q6W5P4 2/20 0.38
ADH1C P00326 1/20 0.38
ADH1A P07327 1/20 0.38
USP2 O75604 1/20 0.37
KDM4E B2RXH2 1/20 0.37
ALOX15 P16050 1/20 0.37
ALOX12 P18054 1/20 0.37
RECQL P46063 1/20 0.37
ADAM17 P78536 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
ALOX5 P09917 1/20 0.36

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
SCHEMBL2090736 0.79 KMT2A (0.44) ALDH1A1KMT2AMEN1TSHRMAPK1
SCHEMBL13622809 0.79 KMT2A (0.44) ALDH1A1KMT2AMEN1TSHRMAPK1
SCHEMBL2090738 0.79 KMT2A (0.44) ALDH1A1KMT2AMEN1TSHRMAPK1
SCHEMBL4145907 0.78 ALDH1A1 (0.56) ALDH1A1KMT2AMEN1TSHRPHGDH
SCHEMBL7080112 0.78 KMT2A (0.41) ALDH1A1KMT2AMEN1TSHRMAPK1
SCHEMBL2096556 0.77 KMT2A (0.42) ALDH1A1KMT2AMEN1TSHRMAPK1
SCHEMBL5430139 0.77 LMNA (0.43) ALDH1A1KMT2AMEN1TSHRMAPK1
SCHEMBL8363501 0.77 KMT2A (0.42) ALDH1A1KMT2AMEN1TSHRMAPK1
SCHEMBL2096559 0.77 KMT2A (0.42) ALDH1A1KMT2AMEN1TSHRMAPK1
SCHEMBL8171738 0.77 KMT2A (0.42) ALDH1A1KMT2AMEN1TSHRMAPK1

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-6492370-B1 Urea derivatives and pharmaceutical compositions thereof SANTEN PHARMACEUTICAL CO., LTD. (JP) 2002-12-10 US disclosed