SCHEMBL24865752

SCHEMBL24865752

CNc1cc(Nc2cc(OC)c(OC)c(OC)c2)ccc1N(C)N=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTK2 Q05397 6/20 0.38
BRAF P15056 3/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
EPHB4 P54760 1/20 0.37
IGF1R P08069 1/20 0.37
GAK O14976 3/20 0.36
EGFR P00533 2/20 0.36
MAPK1 P28482 2/20 0.36
RIPK2 O43353 2/20 0.36
COQ8A Q8NI60 2/20 0.36
NLK Q9UBE8 2/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
GFER P55789 1/20 0.36
MCL1 Q07820 1/20 0.36
BMPR1B O00238 1/20 0.36
EPHB6 O15197 1/20 0.36
ABL1 P00519 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
SCHEMBL24865708 0.79 MEN1 (0.33) MEN1KMT2AMAPK1ALDH1A1LMNA
SCHEMBL24865601 0.74 MEN1 (0.31) MEN1KMT2AALDH1A1LMNAMAPT
SCHEMBL24865688 0.73 EGFR (0.47) MEN1KMT2AEGFRMAPK1ALDH1A1
SCHEMBL24865612 0.71 PKM (0.38) MEN1KMT2AEGFRMAPK1LMNA
SCHEMBL24865739 0.69 ENPP2 (0.40) MEN1KMT2AALDH1A1LMNAMAPT
SCHEMBL24865658 0.68 SYK (0.34) MEN1KMT2AMAPK1ALDH1A1MAPT
SCHEMBL24865643 0.68 PDGFRB (0.37) MEN1KMT2AMAPK1ALDH1A1MAPT
SCHEMBL17948239 0.65 MEN1 (0.71) BRAFMEN1KMT2AGAKEGFR
SCHEMBL24865623 0.64 KDM1A (0.39) BRAFMEN1KMT2AEGFRMAPK1
SCHEMBL3631829 0.64 BRAF (0.70) BRAFMEN1KMT2AGAKEGFR

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-2023280296-A1 FERROPTOSIS MODULATORS, PREPARATIONS, AND USES THEREOF Sironax Ltd. (KY) 2023-01-12 WO disclosed