SCHEMBL6233685

SCHEMBL6233685

CCCc1c(Cl)ccc(OC(=O)O)c1O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 4/20 0.37
PPARA Q07869 4/20 0.37
PPARD Q03181 3/20 0.36
LMNA P02545 2/20 0.36
MAPT P10636 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
NFKB1 P19838 1/20 0.36
BLM P54132 1/20 0.36
GRM2 Q14416 1/20 0.36
NCEH1 Q6PIU2 1/20 0.36
CYSLTR2 Q9NS75 3/20 0.36
CYSLTR1 Q9Y271 3/20 0.36
TSHR P16473 1/20 0.35
NPC1 O15118 1/20 0.35
CASP3 P42574 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
SENP8 Q96LD8 1/20 0.35
SENP7 Q9BQF6 1/20 0.35

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
SCHEMBL6232728 0.91 AKR1C2 (0.39) PPARGPPARAPPARDLMNANCEH1
SCHEMBL5587875 0.83 LDHA (0.41) PPARGPPARAPPARDLMNAMAPT
SCHEMBL5680670 0.83 CYP1A2 (0.40) PPARGPPARAPPARDLMNAMAPT
SCHEMBL5588622 0.83 PRKCI (0.41) PPARGPPARAPPARDLMNAMAPT
SCHEMBL6232359 0.83 MAPT (0.40) PPARGPPARAPPARDLMNAMAPT
SCHEMBL5586621 0.81 LDHA (0.37) PPARGPPARAPPARDLMNAMAPT
SCHEMBL6230820 0.81 CYP1A2 (0.36) PPARGPPARAPPARDLMNAMAPT
SCHEMBL6233270 0.81 CYP1A2 (0.44) PPARGPPARAPPARDLMNAMAPT
SCHEMBL6232644 0.81 LMNA (0.36) PPARGPPARAPPARDLMNAMAPT
SCHEMBL6232138 0.80 CYP1A2 (0.49) PPARGPPARAPPARDLMNAMAPT

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
EP-1521758-A1 LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION Exxonmobil Chemical Patents Inc. (US) 2005-04-13 EP disclosed
WO-2004007509-A1 LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-01-22 WO disclosed