SCHEMBL25916786

SCHEMBL25916786

C[C@@H]1CN(C(=O)OC(C)(C)C)CCC1NC(=O)C(F)(F)F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.46
USP30 Q70CQ3 2/20 0.42
HPGD P15428 1/20 0.42
RECQL P46063 1/20 0.40
PTPN2 P17706 1/20 0.40
PTPN1 P18031 1/20 0.40
PTPN6 P29350 1/20 0.40
HDAC4 P56524 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
STS P08842 1/20 0.39
ALDH1A1 P00352 2/20 0.39
MEN1 O00255 1/20 0.39
MAPT P10636 1/20 0.39
KMT2A Q03164 1/20 0.39
SSTR4 P31391 4/20 0.39
SSTR1 P30872 3/20 0.39
CYP2C9 P11712 1/20 0.39
HSD11B1 P28845 1/20 0.39
USP2 O75604 1/20 0.38
SMN1; SMN2 Q16637 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
SCHEMBL25322431 1.00 EPHX1 (0.46) EPHX1USP30HPGDRECQLPTPN2
SCHEMBL25321057 1.00 EPHX1 (0.46) EPHX1USP30HPGDRECQLPTPN2
SCHEMBL12280117 1.00 EPHX1 (0.46) EPHX1USP30HPGDRECQLPTPN2
SCHEMBL5644308 0.85 EPHX1 (0.45) EPHX1USP30HPGDRECQLPTPN2
SCHEMBL1457410 0.83 EPHX1 (0.55) EPHX1USP30HDAC4HDAC6ALDH1A1
SCHEMBL24817359 0.83 EPHX1 (0.55) EPHX1USP30HDAC4HDAC6ALDH1A1
SCHEMBL6865392 0.83 EPHX1 (0.55) EPHX1USP30HDAC4HDAC6ALDH1A1
SCHEMBL19540973 0.81 EPHX1 (0.48) EPHX1USP30HPGDRECQLPTPN2
SCHEMBL22626896 0.81 EPHX1 (0.46) EPHX1USP30HPGDRECQLPTPN2
SCHEMBL22624428 0.81 EPHX1 (0.46) EPHX1USP30HPGDRECQLPTPN2

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-2023146990-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. (US) 2023-08-03 WO disclosed