SCHEMBL26985019

SCHEMBL26985019

Cc1ccnc(N(C(=O)O)C(=O)OC(C)(C)C)c1F

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 1/20 0.40
KDM4E B2RXH2 1/20 0.33
ASPH Q12797 1/20 0.33
KDM8 Q8N371 1/20 0.33
ATR Q13535 1/20 0.32
SYK P43405 1/20 0.31
BACE1 P56817 1/20 0.31
BACE2 Q9Y5Z0 1/20 0.31
ABL1 P00519 1/20 0.31
USP30 Q70CQ3 1/20 0.31
TACR1 P25103 1/20 0.31
AAK1 Q2M2I8 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
SCHEMBL26984974 0.93 SSTR4 (0.43) SSTR4ATRSYKBACE1BACE2
SCHEMBL31613428 0.82 SSTR4 (0.41) SSTR4KDM4EASPHKDM8ATR
SCHEMBL18013606 0.81 SSTR4 (0.42) SSTR4ATRSYKBACE1BACE2
SCHEMBL3466985 0.79 SSTR4 (0.36) SSTR4ATRSYKUSP30TACR1
SCHEMBL26968143 0.78 SSTR4 (0.36) SSTR4KDM4EASPHKDM8ATR
SCHEMBL29100813 0.78 SSTR4 (0.44) SSTR4ATRSYKBACE1BACE2
SCHEMBL26985281 0.77 SSTR4 (0.35) SSTR4
SCHEMBL22207282 0.76 SSTR4 (0.34) SSTR4ATRSYK
SCHEMBL3467897 0.76 SSTR4 (0.40) SSTR4ATRSYKUSP30TACR1
SCHEMBL960537 0.76 ATR (0.36) SSTR4ATRSYKUSP30AAK1

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-2024010925-A2 MITOGEN-ACTIVATED PROTEIN KINASE (MEK) INHIBITORS NESTED THERAPEUTICS, INC. (US) 2024-01-11 WO disclosed