SCHEMBL28189059

SCHEMBL28189059

CC(C)(C)OC(=O)NC1(C(=O)O)CCN(C(=O)O)C1

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.33
CYP4A11 Q02928 1/20 0.33
EPHX2 P34913 1/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
MAPK1 P28482 1/20 0.32
TSHR P16473 3/20 0.31
ALOX15 P16050 1/20 0.31
ATM Q13315 1/20 0.31
USP2 O75604 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CTSK P43235 2/20 0.31
GHSR Q92847 1/20 0.31
DRD2 P14416 1/20 0.30
CCR1 P32246 1/20 0.30
ALDH1A1 P00352 1/20 0.30
PREP P48147 1/20 0.30

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
SCHEMBL1003478 0.91 EPHX2 (0.34) CYP4F2CYP4A11EPHX2MEN1KMT2A
SCHEMBL21777669 0.90 EPHX2 (0.40) EPHX2TSHRALOX15ATMUSP2
SCHEMBL1002483 0.84 CYP4F2 (0.36) CYP4F2CYP4A11EPHX2MEN1KMT2A
SCHEMBL4463790 0.84 DRD2 (0.33) EPHX2MEN1KMT2AMAPK1USP2
SCHEMBL391708 0.84 USP2 (0.45) EPHX2MEN1KMT2ATSHRALOX15
SCHEMBL3938077 0.82 HSD11B1 (0.33) EPHX2MEN1KMT2AMAPK1TSHR
SCHEMBL1282312 0.82 PPIA (0.34) CYP4F2CYP4A11EPHX2MEN1KMT2A
SCHEMBL4522936 0.82 HPGD (0.39) EPHX2MEN1KMT2AUSP2SMN1; SMN2
SCHEMBL30069367 0.81 CA1 (0.33) EPHX2CA1CA2
SCHEMBL13737672 0.81 EPHX2 (0.36) CYP4F2CYP4A11EPHX2MEN1KMT2A

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
CN-105102456-B Azaquinazoline inhibitors of atypical protein kinase C 癌症研究技术有限公司 2017-11-14 CN disclosed