SCHEMBL26429017

SCHEMBL26429017

C=Cc1cnc2c(n1)CN(OC(=O)c1ccccc1)C2

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.33
LMNA P02545 3/20 0.33
F2 P00734 1/20 0.33
KMT2A Q03164 4/20 0.32
MAPT P10636 1/20 0.32
MEN1 O00255 2/20 0.32
TSHR P16473 2/20 0.31
AKT1 P31749 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
METAP2 P50579 1/20 0.31
METAP1 P53582 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GRM5 P41594 1/20 0.30
CYP2C9 P11712 1/20 0.30
MAPK1 P28482 2/20 0.30
PKM P14618 1/20 0.30

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
SCHEMBL26429018 0.89 NPSR1 (0.34) NPSR1LMNAF2KMT2AMAPT
SCHEMBL26429016 0.81 LMNA (0.35) NPSR1LMNAF2KMT2AMAPT
SCHEMBL26429014 0.78 LMNA (0.42) NPSR1LMNAF2KMT2AMAPT
SCHEMBL25690687 0.71 ABHD6 (0.44) NPSR1LMNAF2KMT2AMAPT
SCHEMBL25771035 0.70 LMNA (0.47) LMNAF2KMT2AMAPTMEN1
SCHEMBL20004202 0.66 LMNA (0.39) LMNAF2KMT2AMAPTMEN1
SCHEMBL25939713 0.63 LMNA (0.50) LMNAF2KMT2AMAPTMEN1
SCHEMBL2510973 0.63 KMT2A (0.50) LMNAF2KMT2AMAPTMEN1
SCHEMBL25770782 0.62 F2 (0.41) LMNAF2KMT2AMAPTMEN1
SCHEMBL1115558 0.62 OPRD1 (0.54) ALDH1A1

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-2023067353-A1 HETEROCYCLIC COMPOUNDS FOR USE IN THE TREATMENT OF CANCER ARTIOS PHARMA LIMITED (GB) 2023-04-27 WO disclosed