SCHEMBL30097022

SCHEMBL30097022

COC(=O)c1cccc(/C=C/c2ccnc(CNC(=O)OC(C)(C)C)c2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P4HB P07237 5/20 0.42
ATR Q13535 1/20 0.39
ACACB O00763 1/20 0.39
ACACA Q13085 1/20 0.39
BRD4 O60885 1/20 0.38
GRIN2D O15399 1/20 0.38
GRIN3B O60391 1/20 0.38
GRIN1 Q05586 1/20 0.38
GRIN2A Q12879 1/20 0.38
GRIN2B Q13224 1/20 0.38
GRIN2C Q14957 1/20 0.38
GRIN3A Q8TCU5 1/20 0.38
KDM4E B2RXH2 2/20 0.38
KDM6B O15054 1/20 0.38
KDM5C P41229 1/20 0.38
KDM4C Q9H3R0 1/20 0.38
KDM2A Q9Y2K7 1/20 0.38
KDM3A Q9Y4C1 1/20 0.38
ALDH1A1 P00352 1/20 0.37
MEN1 O00255 1/20 0.37

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
SCHEMBL23705885 1.00 P4HB (0.42) P4HBATRACACBACACABRD4
SCHEMBL23706002 0.87 KDM4A (0.44) ACACBACACABRD4KDM4EALDH1A1
SCHEMBL12682404 0.84 ATR (0.47) ATRACACBACACABRD4KDM4E
SCHEMBL31133034 0.84 ATR (0.47) ATRACACBACACABRD4KDM4E
SCHEMBL3416327 0.84 ACACB (0.45) ATRACACBACACABRD4KDM4E
SCHEMBL30096997 0.81 ACACB (0.40) ATRACACBACACABRD4KDM4E
SCHEMBL23705963 0.81 ACACB (0.40) ATRACACBACACABRD4KDM4E
SCHEMBL29792768 0.80 KDM4A (0.39) ATRACACBACACABRD4KDM4E
SCHEMBL23705888 0.80 LOXL2 (0.51) P4HBGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL30992907 0.79 P4HB (0.48) P4HBGRIN2DGRIN3BGRIN1GRIN2A

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
EP-4096667-A1 COMPOUNDS AND USES THEREOF Foghorn Therapeutics Inc. (US) 2022-12-07 EP disclosed