SCHEMBL7219386

SCHEMBL7219386

Cc1cc(C)c(-c2c(O)c(C)c(-c3ccc(Cl)cc3)oc2=O)c(C)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.46
CSNK2A2 P19784 2/20 0.46
CSNK2B P67870 2/20 0.46
CSNK2A1 P68400 2/20 0.46
TP53 P04637 1/20 0.46
ADORA3 P0DMS8 1/20 0.41
CA12 O43570 1/20 0.38
CA9 Q16790 1/20 0.38
GAA P10253 1/20 0.38
DHODH Q02127 1/20 0.38
KDM4E B2RXH2 3/20 0.37
ALDH1A1 P00352 3/20 0.37
HPGD P15428 2/20 0.37
LMNA P02545 1/20 0.37
POLB P06746 1/20 0.37
APEX1 P27695 1/20 0.37
BLM P54132 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
PTGS2 P35354 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
SCHEMBL8476247 0.89 CSNK2A2 (0.46) MAPTCSNK2A2CSNK2BCSNK2A1TP53
SCHEMBL812046 0.79 NPC1 (0.41) GAAKDM4EPOLBMAOBCYP1A2
SCHEMBL7218215 0.79 TMIGD3 (0.40) MAOB
SCHEMBL6558583 0.76 PTGS2 (0.39) MAPTCSNK2A2CSNK2BCSNK2A1TP53
SCHEMBL8475129 0.74 ADORA3 (0.39) MAPTCSNK2A2CSNK2BCSNK2A1TP53
SCHEMBL7223445 0.73 ADORA3 (0.37) MAPTCSNK2A2CSNK2BCSNK2A1TP53
SCHEMBL7223514 0.73 MAOA (0.41) MAPTTP53KDM4EALDH1A1HPGD
SCHEMBL18724350 0.71 ALDH1A1 (0.41) MAPTADORA3CA12GAAKDM4E
SCHEMBL13002777 0.70 ALDH1A1 (0.43) MAPTADORA3CA12GAAKDM4E
SCHEMBL811946 0.70 BRD4 (0.37) MAPTCSNK2A2CSNK2BCSNK2A1TP53

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6576771-B1 Pesticides, herbicides and fungicides BAYER AKTIENGESELLSCHAFT (DE) 2003-06-10 US disclosed
EP-0865438-B1 OXYMETHOXY-3-ARYL-PYRONE DERIVATIVES BAYER AG (DE) 2001-10-17 EP disclosed
US-6071937-A PESTICIDES, FUNGICIDES, INSECTICIDES, HERBICIDES, MITICIDES, PARASITICIDES BAYER AKTIENGESELLSCHAFT (DE) 2000-06-06 US disclosed
EP-0865438-A1 OXYMETHOXY-3-ARYL-PYRONE DERIVATIVES BAYER AG (DE) 1998-09-23 EP disclosed