SCHEMBL7201017

SCHEMBL7201017

CC(C(=O)O)c1c(C(=O)c2cc(CO[Si](C)(C)C(C)(C)C)ccn2)[nH]c2cc(Cl)ccc12

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 11/20 0.39
PTGS2 P35354 8/20 0.39
PTGS1 P23219 2/20 0.38
MEN1 O00255 1/20 0.38
ABCC4 O15439 1/20 0.38
C5 P01031 1/20 0.38
MAPT P10636 1/20 0.38
KMT2A Q03164 1/20 0.38
PDE4D Q08499 1/20 0.38
MDM4 O15151 4/20 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
SCHEMBL7203429 0.93 PTGS2 (0.40) MDM2PTGS2PTGS1MEN1ABCC4
SCHEMBL6172840 0.85 PTGS2 (0.44) MDM2PTGS2PTGS1MEN1ABCC4
SCHEMBL6174363 0.85 PTGS2 (0.49) MDM2PTGS2PTGS1MEN1ABCC4
SCHEMBL6180884 0.84 PTGS2 (0.57) PTGS2PTGS1
SCHEMBL7203012 0.84 PTGS2 (0.42) MDM2PTGS2PTGS1MEN1ABCC4
SCHEMBL6169322 0.83 PTGS2 (0.45) MDM2PTGS2PTGS1MEN1ABCC4
SCHEMBL8161919 0.83 PTGS2 (0.38) MDM2PTGS2PTGS1
SCHEMBL6170606 0.82 PTGS2 (0.48) MDM2PTGS2PTGS1MEN1ABCC4
SCHEMBL7506364 0.82 PTGS2 (0.38) MDM2PTGS2PTGS1
SCHEMBL27554804 0.82 PTGS2 (0.43) PTGS2PTGS1

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-6608070-B1 Useful for treatment of medical condition in which prostaglandins are implicated as pathogens NAKAO KAZUNARI (JP) 2003-08-19 US disclosed