SCHEMBL7202476

SCHEMBL7202476

CC(C(=O)O)c1cn(C(=O)C2CCC2)c2cc(Cl)ccc12

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 3/20 0.40
CNR2 P34972 3/20 0.40
IDE P14735 1/20 0.39
PTGS2 P35354 4/20 0.38
GAA P10253 1/20 0.37
HPGD P15428 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MEN1 O00255 1/20 0.37
ABCC4 O15439 1/20 0.37
C5 P01031 1/20 0.37
MAPT P10636 1/20 0.37
PTGS1 P23219 1/20 0.37
KMT2A Q03164 1/20 0.37
PDE4D Q08499 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
SCHEMBL7202738 0.95 PTGS2 (0.40) PTGS2MEN1ABCC4C5MAPT
SCHEMBL6169150 0.77 AKR1C3 (0.44) IDEPTGS1
SCHEMBL6169838 0.74 AKR1C3 (0.47) IDEHPGDMAPTPTGS1
SCHEMBL6171169 0.72 AKR1C3 (0.46) PTGS1
SCHEMBL7202731 0.71 LMNA (0.39) PTGS2MAPTKMT2A
SCHEMBL7241953 0.69 KMT2A (0.48) PTGS2MEN1ABCC4C5MAPT
SCHEMBL6172688 0.68 AKR1C3 (0.49) HPGDMAPTPTGS1
SCHEMBL2000060 0.68 BAZ2B (0.38) PTGS2HPGDSMN1; SMN2MEN1MAPT
SCHEMBL25139928 0.67 PSEN1 (0.45) IDEHPGDSMN1; SMN2MEN1KMT2A
SCHEMBL30708155 0.67 PSEN1 (0.45) IDEHPGDSMN1; SMN2MEN1KMT2A

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