SCHEMBL7203148

SCHEMBL7203148

Cc1ccnc(C(=O)c2[nH]c3cc(Cl)c(Cl)cc3c2CC(=O)O)c1C

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 13/20 0.59
PTGS1 P23219 7/20 0.59
KDM4E B2RXH2 2/20 0.40
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL6169395 0.88 PTGS2 (0.53) PTGS2PTGS1MEN1GAAMAPT
SCHEMBL6169728 0.82 PTGS2 (0.84) PTGS2PTGS1KDM4EMEN1ALDH1A1
SCHEMBL28744503 0.77 PTGS1 (0.45) PTGS2PTGS1KDM4EMEN1ALDH1A1
SCHEMBL6169798 0.76 PTGS2 (0.51) PTGS2PTGS1KDM4EALDH1A1GAA
SCHEMBL6169641 0.75 PTGS2 (0.59) PTGS2PTGS1
SCHEMBL6170649 0.75 PTGS2 (0.51) PTGS2PTGS1KDM4EMEN1ALDH1A1
SCHEMBL6169251 0.74 PTGS2 (1.00) PTGS2PTGS1KDM4EMEN1ALDH1A1
SCHEMBL9449371 0.73 KDM4E (0.56) PTGS2PTGS1KDM4EMAPT
SCHEMBL11331485 0.72 KDM4E (0.63) PTGS2PTGS1KDM4EMEN1ALDH1A1
SCHEMBL6171850 0.72 PTGS2 (0.61) 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