SCHEMBL25707355

SCHEMBL25707355

COC(=O)/N=C1/C(=O)N(c2ccccc2)c2ccccc21

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.60
KMT2A Q03164 6/20 0.60
CTDSP1 Q9GZU7 1/20 0.60
MEN1 O00255 2/20 0.58
ALDH1A1 P00352 4/20 0.56
CYP1A2 P05177 1/20 0.56
CYP2C9 P11712 1/20 0.56
CYP2C19 P33261 1/20 0.56
NPSR1 Q6W5P4 2/20 0.55
LMNA P02545 1/20 0.55
CES2 O00748 1/20 0.50
BCHE P06276 1/20 0.50
GAA P10253 1/20 0.50
CES1 P23141 1/20 0.50
ACE P12821 2/20 0.49
GALR3 O60755 1/20 0.45
HTR4 Q13639 1/20 0.45
F2 P00734 1/20 0.44
HPGD P15428 1/20 0.44
ATM Q13315 1/20 0.44

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
SCHEMBL25708310 0.85 MAPT (0.51) MAPTKMT2ACTDSP1MEN1ALDH1A1
SCHEMBL25708153 0.84 MAPT (0.52) MAPTKMT2ACTDSP1MEN1ALDH1A1
SCHEMBL25706962 0.81 KMT2A (0.60) MAPTKMT2AMEN1ALDH1A1CYP1A2
SCHEMBL24049866 0.80 KMT2A (0.46) MAPTKMT2ACTDSP1MEN1ALDH1A1
SCHEMBL6323811 0.80 MAPT (0.72) MAPTKMT2ACTDSP1MEN1ALDH1A1
SCHEMBL6323819 0.80 MAPT (0.72) MAPTKMT2ACTDSP1MEN1ALDH1A1
SCHEMBL25706957 0.79 KMT2A (0.56) MAPTKMT2ACTDSP1MEN1ALDH1A1
SCHEMBL6322884 0.77 ALDH1A1 (0.61) MAPTKMT2ACTDSP1MEN1ALDH1A1
SCHEMBL13628014 0.77 ALDH1A1 (0.61) MAPTKMT2ACTDSP1MEN1ALDH1A1
SCHEMBL13086556 0.77 MAPT (0.64) MAPTKMT2ACTDSP1MEN1ALDH1A1

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
US-20230183391-A1 BIOMASS DERIVED DIKETONES AS EFFICIENT VISIBLE LIGHT PHOTOINITIATORS BOWLING GREEN STATE UNIVERSITY (US) 2023-06-15 US disclosed