SCHEMBL8524478

SCHEMBL8524478

Fc1cccc(Nc2nc(Cl)nc(Nc3ccccc3)n2)c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.71
▸ KMT2A Q03164 2/20 0.71
▸ MAPT P10636 1/20 0.71
▸ MAPK1 P28482 1/20 0.71
▸ NFKB1 P19838 2/20 0.66
▸ APP P05067 4/20 0.62
▸ LMNA P02545 1/20 0.61
▸ NPC1 O15118 2/20 0.56
▸ RAB9A P51151 2/20 0.56
▸ KDM4E B2RXH2 1/20 0.56
▸ TP53 P04637 1/20 0.56
▸ ALOX15 P16050 1/20 0.56
▸ TSHR P16473 1/20 0.56
▸ SMN1; SMN2 Q16637 1/20 0.56
▸ TAAR1 Q96RJ0 1/20 0.56
▸ HSD17B10 Q99714 1/20 0.56
▸ IDH2 P48735 1/20 0.54
▸ TXN P10599 1/20 0.53
▸ CA12 O43570 1/20 0.52
▸ CA1 P00915 1/20 0.52

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
SCHEMBL2874930 0.92 NFKB1 (0.65) MEN1KMT2AMAPTMAPK1NFKB1
SCHEMBL22123529 0.87 ABCG2 (0.58) MEN1KMT2AMAPTMAPK1NFKB1
SCHEMBL8525000 0.86 TP53 (0.59) MEN1KMT2AMAPTAPPNPC1
SCHEMBL1925527 0.85 MEN1 (0.79) MEN1KMT2AMAPTMAPK1NFKB1
SCHEMBL30933599 0.84 APP (0.54) MEN1KMT2AMAPTMAPK1NFKB1
SCHEMBL8525007 0.84 MEN1 (0.53) MEN1KMT2AMAPTMAPK1NFKB1
SCHEMBL1923883 0.84 MAPT (1.00) MEN1KMT2AMAPTMAPK1NFKB1
SCHEMBL27598771 0.82 CDC7 (0.69) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL1390952 0.82 KCNH3 (0.64) MEN1KMT2AMAPTNFKB1APP
SCHEMBL8297647 0.81 TP53 (0.52) MEN1KMT2AMAPTNFKB1APP

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-1999001442-A1 TRIAZINE DERIVATIVES AND THEIR USE AS ANTIBACTERIAL AGENTS ZENECA LIMITED (GB) 1999-01-14 — — WO disclosed
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