SCHEMBL7654082

SCHEMBL7654082

COC(=O)c1ccc(CN2C(=O)c3ccccc3C2=O)c(Cl)c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
RXFP1 Q9HBX9 1/20 0.56
MAPK1 P28482 2/20 0.54
HSD17B10 Q99714 1/20 0.54
POLB P06746 4/20 0.52
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
CA4 P22748 1/20 0.52
CA9 Q16790 1/20 0.52
TP53 P04637 4/20 0.52
LMNA P02545 2/20 0.52
TSHR P16473 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
MAPT P10636 1/20 0.50
GRM5 P41594 1/20 0.48
HDAC1 Q13547 1/20 0.48
HDAC7 Q8WUI4 1/20 0.48
CACNA1G O43497 1/20 0.45
CDC25A P30304 1/20 0.45

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
SCHEMBL15492070 0.85 HPGD (0.48) MEN1KMT2AMAPK1HSD17B10POLB
SCHEMBL11820042 0.82 KMT2A (0.45) MEN1KMT2ARXFP1MAPK1HSD17B10
SCHEMBL14597968 0.81 HDAC1 (0.67) MEN1KMT2ARXFP1MAPK1HSD17B10
SCHEMBL13007428 0.80 MEN1 (0.46) MEN1KMT2ARXFP1HSD17B10TSHR
SCHEMBL6940053 0.79 CASP3 (0.58) RXFP1LMNAGRM5
SCHEMBL16891467 0.79 POLB (0.46) MEN1KMT2AMAPK1POLBLMNA
SCHEMBL18132362 0.79 CACNA1G (0.60) MEN1KMT2ARXFP1MAPK1HSD17B10
SCHEMBL12700357 0.79 CA1 (0.57) MEN1KMT2ARXFP1MAPK1HSD17B10
SCHEMBL7549204 0.78 MAPK1 (0.50) MEN1KMT2ARXFP1MAPK1HSD17B10
SCHEMBL31753576 0.77 KMT2A (0.70) MEN1KMT2ARXFP1MAPK1HSD17B10

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
US-6403578-B1 ANTICOAGULANTS, CARDIOVASCULAR DISORDERS SMITHKLINE BEECHAM CORPORATION 2002-06-11 US disclosed