SCHEMBL25376236

SCHEMBL25376236

CCOC(=O)C(=O)N(Cc1ccccn1)Cc1ccccc1C.Cc1ccccc1CNCc1ccccn1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.45
TRPM8 Q7Z2W7 1/20 0.44
ALDH1A1 P00352 5/20 0.44
NPSR1 Q6W5P4 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.42
TSHR P16473 1/20 0.42
RAB9A P51151 1/20 0.41
SCN8A Q9UQD0 1/20 0.41
MAPT P10636 4/20 0.40
GAA P10253 2/20 0.40
POLB P06746 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
SLC6A2 P23975 1/20 0.40
SLC6A4 P31645 1/20 0.40
SLC6A3 Q01959 1/20 0.40
ALOX15 P16050 1/20 0.39
YWHAG P61981 1/20 0.39
HSD17B10 Q99714 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
MEN1 O00255 1/20 0.38

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
SCHEMBL25373373 0.92 KDM4E (0.51) KDM4ETRPM8ALDH1A1NPSR1L3MBTL1
SCHEMBL25376566 0.90 TRPM8 (0.52) KDM4ETRPM8ALDH1A1L3MBTL1RAB9A
SCHEMBL25377547 0.87 KDM4E (0.47) KDM4ETRPM8ALDH1A1NPSR1L3MBTL1
SCHEMBL25375864 0.86 SMN1; SMN2 (0.42) KDM4ETRPM8ALDH1A1NPSR1L3MBTL1
SCHEMBL25378671 0.85 ALDH1A1 (0.45) KDM4ETRPM8ALDH1A1NPSR1L3MBTL1
SCHEMBL25377034 0.84 L3MBTL1 (0.41) KDM4ETRPM8ALDH1A1NPSR1L3MBTL1
SCHEMBL25377449 0.84 TRPM8 (0.57) KDM4ETRPM8ALDH1A1L3MBTL1TSHR
SCHEMBL25375830 0.81 TRPM8 (0.52) TRPM8ALDH1A1NPSR1L3MBTL1TSHR
SCHEMBL26216106 0.80 TRPM8 (0.49) KDM4ETRPM8ALDH1A1NPSR1L3MBTL1
SCHEMBL25376111 0.80 TRPM8 (0.47) KDM4ETRPM8ALDH1A1NPSR1TSHR

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-2023146987-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. (US) 2023-08-03 WO disclosed