SCHEMBL25328385

SCHEMBL25328385

CC(=O)N1CC(c2ccccc2)N(C(=O)O)CC1C

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.50
MEN1 O00255 1/20 0.42
TSHR P16473 1/20 0.42
HTT P42858 1/20 0.42
KMT2A Q03164 1/20 0.42
OPRM1 P35372 1/20 0.42
OPRK1 P41145 1/20 0.42
RIPK1 Q13546 4/20 0.41
CYP3A4 P08684 1/20 0.40
CYP2C19 P33261 1/20 0.40
NOTUM Q6P988 1/20 0.40
HHAT Q5VTY9 1/20 0.39
KIF11 P52732 5/20 0.38
ABCB1 P08183 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
SCHEMBL25328383 1.00 POLB (0.50) POLBMEN1TSHRHTTKMT2A
SCHEMBL25324288 0.85 POLB (0.45) POLBMEN1TSHRHTTKMT2A
SCHEMBL18711396 0.85 POLB (0.61) POLBMEN1TSHRHTTKMT2A
SCHEMBL4657693 0.85 RIPK1 (0.47) POLBMEN1KMT2ARIPK1
SCHEMBL4657697 0.85 RIPK1 (0.47) POLBMEN1KMT2ARIPK1
SCHEMBL25327354 0.84 RIPK1 (0.58) RIPK1
SCHEMBL25326983 0.82 NR1H2 (0.48) POLBRIPK1ABCB1
SCHEMBL25326986 0.82 NR1H2 (0.48) POLBRIPK1ABCB1
SCHEMBL25327211 0.81 PRMT5 (0.39) POLBRIPK1
SCHEMBL25326948 0.79 RIPK1 (0.42) POLBOPRM1OPRK1RIPK1

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-2023146991-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. (US) 2023-08-03 WO disclosed