SCHEMBL6581399

SCHEMBL6581399

NC(=O)C=Cc1nc2ccccc2n1-c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.51
KMT2A Q03164 6/20 0.51
TSHR P16473 3/20 0.51
MAPK1 P28482 2/20 0.51
USP2 O75604 1/20 0.51
RECQL P46063 2/20 0.47
HTT P42858 1/20 0.46
ALDH1A1 P00352 4/20 0.45
CRHBP P24387 2/20 0.45
CRHR2 Q13324 2/20 0.45
SLC22A12 Q96S37 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
HDAC1 Q13547 1/20 0.45
HDAC8 Q9BY41 1/20 0.45
HDAC6 Q9UBN7 1/20 0.45
MAPT P10636 3/20 0.43
POLB P06746 3/20 0.41
GAA P10253 1/20 0.41
GFER P55789 1/20 0.41
KLK7 P49862 1/20 0.41

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
SCHEMBL6581397 1.00 MEN1 (0.51) MEN1KMT2ATSHRMAPK1USP2
SCHEMBL6585397 0.88 RECQL (0.49) MEN1KMT2ATSHRMAPK1USP2
SCHEMBL6585394 0.88 RECQL (0.49) MEN1KMT2ATSHRMAPK1USP2
SCHEMBL6583378 0.77 KDM4E (0.64) MEN1KMT2AMAPK1HTTALDH1A1
SCHEMBL6583386 0.77 KDM4E (0.64) MEN1KMT2AMAPK1HTTALDH1A1
SCHEMBL8550750 0.77 KDM4E (0.64) MEN1KMT2AMAPK1HTTALDH1A1
SCHEMBL2086648 0.77 MAPK1 (0.56) MEN1KMT2ATSHRMAPK1USP2
SCHEMBL8551152 0.74 GFER (0.53) MEN1KMT2APOLBGAAGFER
SCHEMBL8551161 0.74 GFER (0.53) MEN1KMT2APOLBGAAGFER
SCHEMBL15079139 0.74 MAPK1 (0.40) MEN1KMT2ATSHRMAPK1USP2

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
EP-0846689-B1 Benzimidazole compounds PFIZER (US) 2004-01-14 EP disclosed
EP-0846689-A1 Benzimidazole compounds PFIZER INC. (US) 1998-06-10 EP disclosed