SCHEMBL7407103

SCHEMBL7407103

N=C(N)c1ccc2[nH]c(C(CCNS(=O)(=O)c3cccc4cccnc34)c3nc4ccccc4[nH]3)nc2c1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.46
PPARG P37231 1/20 0.43
POLB P06746 1/20 0.42
F2 P00734 3/20 0.42
KMT2A Q03164 4/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HTR6 P50406 1/20 0.41
KCNH2 Q12809 1/20 0.41
ST14 Q9Y5Y6 1/20 0.41
ALOX15 P16050 2/20 0.40
TSHR P16473 1/20 0.40
F10 P00742 2/20 0.39
F7 P08709 2/20 0.39
QPCT Q16769 1/20 0.38
SLC16A3 O15427 1/20 0.38
PKLR P30613 1/20 0.37
HTR7 P34969 1/20 0.37

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
SCHEMBL7510263 0.90 F2 (0.43) F2KMT2AKDM4EMEN1ALDH1A1
SCHEMBL7405075 0.83 F2 (0.44) F2ALDH1A1ST14F10F7
SCHEMBL7510086 0.82 F10 (0.45) F2KMT2AALDH1A1F10F7
SCHEMBL7408796 0.82 F2 (0.44) F2KMT2AMEN1F10F7
SCHEMBL7406764 0.77 F2 (0.37) F2ALDH1A1F10F7
SCHEMBL7407099 0.76 F2 (0.50) SMN1; SMN2PPARGPOLBF2KMT2A
SCHEMBL7403772 0.76 F10 (0.47) F2ALDH1A1F10F7
SCHEMBL7405163 0.75 F2 (0.53) F2F10F7
SCHEMBL7591356 0.74 F10 (0.39) F2ST14F10F7
SCHEMBL7397941 0.72 F7 (0.50) F2ALDH1A1F10F7

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-1999026932-A1 BY AMIDINO GROUP SUBSTITUTED HETEROCYCLIC DERIVATIVES AND THEIR USE AS ANTICOAGULANTS AXYS PHARMACEUTICALS, INC. (US) 1999-06-03 WO disclosed