SCHEMBL30186008

SCHEMBL30186008

CC(=O)n1c(=O)cc[nH]c1=O

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.38
BRD4 O60885 1/20 0.33
TAF1 P21675 1/20 0.33
BRPF1 P55201 1/20 0.33
CREBBP Q92793 1/20 0.33
CECR2 Q9BXF3 1/20 0.33
BRD9 Q9H8M2 1/20 0.33
ELANE P08246 1/20 0.32
TP53 P04637 1/20 0.31
MAPK1 P28482 1/20 0.31
GAA P10253 2/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
GLA P06280 1/20 0.31
HPGD P15428 1/20 0.31
HSD17B10 Q99714 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL8943286 0.78 TP53 (0.35) POLBTP53ALDH1A1
SCHEMBL28132698 0.78 MAP2K1 (0.35) POLBALDH1A1
SCHEMBL2239295 0.76 BRD4 (0.33) BRD4TAF1BRPF1CREBBPCECR2
Acetic Acid SCHEMBL27914598 0.74 BRD4 (0.31) POLBBRD4TAF1BRPF1CREBBP
SCHEMBL5811350 0.74 JAK1 (0.34) KDM4EALDH1A1
SCHEMBL13629866 0.72 PDE4A (0.36) POLBGAAKDM4EALDH1A1SMN1; SMN2
SCHEMBL422814 0.70
SCHEMBL27983204 0.70 BRD4 (0.41) BRD4TAF1BRPF1CREBBPCECR2
SCHEMBL40761 0.70
SCHEMBL27480973 0.70

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-115811990-A Novel nucleolin binding peptides and uses thereof 安尼根有限公司 2023-03-17 CN disclosed