SCHEMBL25937779

SCHEMBL25937779

COc1ccc2c(c1)OCCN2C(=O)CNC(=O)OC(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDR P35968 7/20 0.43
LCK P06239 6/20 0.43
MET P08581 5/20 0.43
THRB P10828 2/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
MMP1 P03956 1/20 0.42
MMP9 P14780 1/20 0.42
MMP13 P45452 1/20 0.42
TP53 P04637 3/20 0.42
MAPT P10636 2/20 0.41
RIPK1 Q13546 1/20 0.41
TEK Q02763 2/20 0.40
USP30 Q70CQ3 1/20 0.40
DYRK1A Q13627 1/20 0.40
SIGMAR1 Q99720 1/20 0.39

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
SCHEMBL25937403 0.86 KCNQ2 (0.41) KDRLCKMETMEN1KMT2A
SCHEMBL25428783 0.86 KDR (0.46) KDRLCKMETTHRBMEN1
SCHEMBL25937424 0.84 NOTUM (0.53) THRBTP53MAPTSIGMAR1
SCHEMBL27983431 0.83 MAPT (0.41) MAPTUSP30
SCHEMBL30557580 0.80 KCNQ2 (0.46) MEN1KMT2ARIPK1USP30SIGMAR1
SCHEMBL25937545 0.80 KCNQ2 (0.46) MEN1KMT2ARIPK1USP30SIGMAR1
SCHEMBL25937840 0.80 SLC22A12 (0.41) MEN1KMT2ARIPK1USP30SIGMAR1
SCHEMBL25937866 0.79 TP53 (0.40) TP53MAPTSIGMAR1
SCHEMBL25937783 0.79 KDR (0.48) KDRLCKMETTHRBMEN1
SCHEMBL25937457 0.78 GRM7 (0.47) THRBTP53MAPTSIGMAR1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023144793-A1 POL THETA INHIBITORS RHIZEN PHARMACEUTICALS AG (CH) 2023-08-03 WO disclosed
WO-2023144793-A1 POL THETA INHIBITORS RHIZEN PHARMACEUTICALS AG (CH) 2023-08-03 WO disclosed