SCHEMBL5344254

SCHEMBL5344254

C=CC(=O)OC(C)(Oc1ccc(Cl)cc1)Oc1ccc(Cl)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 8/20 0.51
CYP1A2 P05177 5/20 0.51
CYP3A4 P08684 5/20 0.51
CYP2C19 P33261 4/20 0.51
MAPT P10636 3/20 0.51
MEN1 O00255 2/20 0.51
CYP2D6 P10635 2/20 0.51
KMT2A Q03164 2/20 0.51
PPARG P37231 3/20 0.45
ABCB11 O95342 2/20 0.45
TSHR P16473 2/20 0.45
HTR2A P28223 2/20 0.45
PMP22 Q01453 2/20 0.45
FABP2 P12104 1/20 0.45
SLC22A12 Q96S37 1/20 0.45
CYP2C9 P11712 3/20 0.40
ALDH1A1 P00352 3/20 0.40
LMNA P02545 2/20 0.40
MAPK1 P28482 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40

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
SCHEMBL28450603 0.83 THRB (0.46) PPARACYP1A2CYP3A4CYP2C19MAPT
SCHEMBL6708124 0.81 ALDH1A1 (0.39) PPARACYP1A2CYP3A4CYP2C19MAPT
SCHEMBL476290 0.75 THRB (0.55) PPARACYP1A2CYP3A4CYP2C19MAPT
SCHEMBL2852281 0.74 PPARA (0.42) PPARACYP1A2CYP3A4CYP2C19MAPT
Chlorobenzene SCHEMBL28079345 0.73 XPO1 (0.40) PPARACYP1A2CYP3A4CYP2C19MAPT
Hydrochloric Acid SCHEMBL27445696 0.73 THRB (0.53) PPARACYP1A2CYP3A4CYP2C19MAPT
SCHEMBL9820429 0.73 PPARA (0.42) PPARACYP1A2CYP3A4CYP2C19MAPT
SCHEMBL2768277 0.73 THRB (0.43) PPARACYP3A4CYP2C19MAPTKMT2A
Fluorene SCHEMBL4456503 0.73 SRD5A2 (0.38) PPARACYP1A2CYP3A4CYP2C19MAPT
SCHEMBL10603222 0.73 MIF (0.39) PPARACYP1A2CYP3A4CYP2C19MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7163769-B2 Photosensitive material and process of making same CHEBEN PAVEL 2007-01-16 US claimed
US-20050161645-A1 Photosensitive material and process of making same CHEBEN PAVEL (CA) 2005-07-28 US claimed
WO-2003077033-A2 PHOTOSENSITIVE MATERIAL AND PROCESS OF MAKING SAME CHEBEN PAVEL (CA) 2003-09-18 WO claimed
US-7163769-B2 Photosensitive material and process of making same CHEBEN PAVEL 2007-01-16 US disclosed
US-20050161645-A1 Photosensitive material and process of making same CHEBEN PAVEL (CA) 2005-07-28 US disclosed
WO-2003077033-A2 PHOTOSENSITIVE MATERIAL AND PROCESS OF MAKING SAME CHEBEN PAVEL (CA) 2003-09-18 WO disclosed