SCHEMBL25375830

SCHEMBL25375830

CCOC(=O)C(=O)N(Cc1ccc(C)cc1)Cc1ccccn1.Cc1ccc(CNCc2ccccn2)cc1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 1/20 0.52
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
TSHR P16473 1/20 0.50
ALDH1A1 P00352 5/20 0.49
HTT P42858 2/20 0.49
RECQL P46063 1/20 0.46
L3MBTL1 Q9Y468 4/20 0.46
AGTR1 P30556 1/20 0.45
SMN1; SMN2 Q16637 5/20 0.44
MAPT P10636 2/20 0.44
GAA P10253 1/20 0.44
NPSR1 Q6W5P4 2/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
CYP3A4 P08684 1/20 0.42

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
SCHEMBL25374361 0.92 TRPM8 (0.59) TRPM8MEN1KMT2ATSHRALDH1A1
SCHEMBL25376566 0.90 TRPM8 (0.52) TRPM8ALDH1A1L3MBTL1SMN1; SMN2MAPT
SCHEMBL25376675 0.87 TRPM8 (0.54) TRPM8MEN1KMT2ATSHRALDH1A1
SCHEMBL25376560 0.85 SMN1; SMN2 (0.44) TRPM8MEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL25377449 0.84 TRPM8 (0.57) TRPM8MEN1KMT2ATSHRALDH1A1
SCHEMBL25373541 0.83 KDM5B (0.47) TRPM8MEN1KMT2AALDH1A1L3MBTL1
SCHEMBL25376236 0.81 KDM4E (0.45) TRPM8MEN1KMT2ATSHRALDH1A1
SCHEMBL25377248 0.81 RECQL (0.51) TRPM8MEN1KMT2ATSHRALDH1A1
SCHEMBL30482189 0.81 RECQL (0.51) TRPM8MEN1KMT2ATSHRALDH1A1
SCHEMBL25374376 0.79 TRPM8 (0.52) TRPM8MEN1KMT2ATSHRALDH1A1

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