SCHEMBL25866708

SCHEMBL25866708

CON(C(=O)OC(C)(C)C)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
RAB9A P51151 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
ATM Q13315 1/20 0.38
BRD4 O60885 1/20 0.38
PAX8 Q06710 1/20 0.37
ALDH1A1 P00352 2/20 0.37
GSK3B P49841 1/20 0.37
TSHR P16473 1/20 0.37
HSD17B10 Q99714 1/20 0.37
F2 P00734 1/20 0.37
AKT1 P31749 2/20 0.36
GPR119 Q8TDV5 1/20 0.36

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
SCHEMBL14907285 0.86 MEN1 (0.40) MEN1KMT2ANPSR1RAB9ACYP3A4
SCHEMBL8736767 0.83 MEN1 (0.43) MEN1KMT2ANPSR1RAB9ACYP3A4
SCHEMBL8706596 0.83 MEN1 (0.38) MEN1KMT2ANPSR1RAB9ACYP3A4
SCHEMBL7022745 0.82 CTSL (0.39) MEN1KMT2ANPSR1RAB9ACYP3A4
SCHEMBL29024419 0.81 TP53 (0.42) MEN1KMT2ANPSR1RAB9ACYP3A4
SCHEMBL13499619 0.81 L3MBTL1 (0.46) MEN1KMT2ANPSR1L3MBTL1TDP1
SCHEMBL19512665 0.81 BRD4 (0.39) MEN1KMT2ABRD4PAX8ALDH1A1
SCHEMBL504005 0.79 L3MBTL1 (0.55) MEN1KMT2ANPSR1RAB9ACYP3A4
SCHEMBL18051150 0.79 L3MBTL1 (0.54) MEN1KMT2ANPSR1CYP3A4CYP2C9
SCHEMBL3780747 0.79 MEN1 (0.40) MEN1KMT2ANPSR1RAB9ACYP3A4

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-2023134608-A1 FUSED RING COMPOUNDS SERVING AS HPK1 INHIBITORS 微境生物医药科技(上海)有限公司 2023-07-20 WO disclosed