SCHEMBL7202069

SCHEMBL7202069

CCOC(CC)c1cc(C(=O)c2[nH]c3ccc(Cl)cc3c2C(C)C(=O)O)on1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 3/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
MAPT P10636 2/20 0.41
ABCC4 O15439 1/20 0.41
C5 P01031 1/20 0.41
PTGS1 P23219 1/20 0.41
PDE4D Q08499 1/20 0.41
ALDH1A1 P00352 2/20 0.38
CYP1A2 P05177 1/20 0.38
HPGD P15428 1/20 0.38
XBP1 P17861 1/20 0.38
CYP2C19 P33261 1/20 0.38
GAA P10253 1/20 0.37
SIRT1 Q96EB6 1/20 0.36
CSF1R P07333 2/20 0.35
POLB P06746 1/20 0.35
KDM4E B2RXH2 2/20 0.34
CNR1 P21554 2/20 0.34
LMNA P02545 1/20 0.34

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
SCHEMBL6172373 0.83 ALDH1A1 (0.48) PTGS2MEN1KMT2AMAPTABCC4
SCHEMBL7202070 0.79 KDM4E (0.44) PTGS2MEN1KMT2AMAPTABCC4
SCHEMBL6171377 0.76 PTGS2 (0.49) PTGS2MEN1KMT2AMAPTABCC4
SCHEMBL6171752 0.71 PTGS2 (0.49) PTGS2MEN1KMT2AMAPTABCC4
SCHEMBL6172049 0.70 PTGS2 (0.47) PTGS2MEN1KMT2AMAPTABCC4
SCHEMBL6173187 0.70 PTGS2 (0.51) PTGS2MEN1KMT2AMAPTABCC4
SCHEMBL6173791 0.70 PTGS2 (0.51) PTGS2MEN1KMT2AMAPTABCC4
SCHEMBL6171454 0.70 PTGS2 (0.44) PTGS2MEN1KMT2AMAPTABCC4
SCHEMBL6174047 0.70 PTGS2 (0.48) PTGS2MEN1KMT2AMAPTABCC4
SCHEMBL6168568 0.69 PTGS2 (0.46) PTGS2MEN1KMT2AMAPTABCC4

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