SCHEMBL27172003

SCHEMBL27172003

C#CCCC(C(=O)OC)C(=O)OC(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.33
CA14 Q9ULX7 1/20 0.33
ACHE P22303 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
DGAT1 O75907 1/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
GAA P10253 1/20 0.32
USP2 O75604 1/20 0.31
ALDH1A1 P00352 1/20 0.31
TP53 P04637 1/20 0.31
CYP3A4 P08684 1/20 0.31
MAPT P10636 1/20 0.31
MAPK1 P28482 1/20 0.31
CTSS P25774 1/20 0.30
CTSK P43235 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
SCHEMBL14720247 0.85 TDP1 (0.35) MEN1KMT2AUSP2ALDH1A1TP53
SCHEMBL16412190 0.80 USP2 (0.47) MEN1KMT2AGAAUSP2ALDH1A1
SCHEMBL28128355 0.79 CA1 (0.44) CA12CA14CA1CA2DGAT1
SCHEMBL2443295 0.77 CA12 (0.36) CA12CA14CA1CA2DGAT1
SCHEMBL2443294 0.77 CA12 (0.36) CA12CA14CA1CA2DGAT1
SCHEMBL27542596 0.77 CA12 (0.36) CA12CA14CA1CA2DGAT1
SCHEMBL25166303 0.76 CTSK (0.45) CA1CA2CTSSCTSK
SCHEMBL21004186 0.76 CTSK (0.45) CA1CA2CTSSCTSK
SCHEMBL28926772 0.76 CA1 (0.55) CA1CA2CTSSCTSK
SCHEMBL28537327 0.76 FOLH1 (0.40) CA12CA14CA1CA2DGAT1

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
EP-4337211-A1 COMPOUNDS AND USES THEREOF Foghorn Therapeutics Inc. (US) 2024-03-20 EP disclosed
CN-117337178-A Compounds and uses thereof 福宏治疗公司 2024-01-02 CN disclosed