SCHEMBL24865601

SCHEMBL24865601

C#Cc1ccc(Nc2ccc(N(C)N=O)c(NC)c2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.31
RGS12 O14924 1/20 0.31
USP2 O75604 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
CYP1A2 P05177 1/20 0.31
POLB P06746 1/20 0.31
CYP2D6 P10635 1/20 0.31
MAPT P10636 1/20 0.31
THRB P10828 1/20 0.31
CYP2C9 P11712 1/20 0.31
PKM P14618 1/20 0.31
HPGD P15428 1/20 0.31
ALOX15 P16050 1/20 0.31
NFKB1 P19838 1/20 0.31
APEX1 P27695 1/20 0.31
CASP1 P29466 1/20 0.31
CYP2C19 P33261 1/20 0.31
BRCA1 P38398 1/20 0.31
THPO P40225 1/20 0.31

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 0.78 MEN1 (0.33) MEN1RGS12USP2ALDH1A1LMNA
SCHEMBL24865688 0.78 EGFR (0.47) MEN1USP2ALDH1A1POLBMAPT
SCHEMBL24865752 0.74 PTK2 (0.38) MEN1ALDH1A1LMNAPOLBMAPT
SCHEMBL24865739 0.73 ENPP2 (0.40) MEN1ALDH1A1LMNACYP1A2CYP2D6
SCHEMBL24865612 0.73 PKM (0.38) MEN1LMNACYP1A2CYP2D6MAPT
SCHEMBL24865658 0.72 SYK (0.34) MEN1ALDH1A1MAPTALOX15KMT2A
SCHEMBL24865643 0.72 PDGFRB (0.37) MEN1ALDH1A1MAPTALOX15KMT2A
SCHEMBL24865300 0.69 CNR2 (0.34) MAPT
SCHEMBL13136690 0.67 HDAC8 (0.43) ALDH1A1CYP1A2MAPTTHRBCYP2C9
SCHEMBL24865727 0.66 MAPK1 (0.30) MEN1ALDH1A1LMNAKMT2A

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