SCHEMBL5506491

SCHEMBL5506491

CC(Oc1ccc(I)cc1)(C(=O)O)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 7/20 0.58
▸ PPARA Q07869 6/20 0.58
▸ KMT2A Q03164 4/20 0.41
▸ MAPT P10636 3/20 0.41
▸ CYP2C19 P33261 3/20 0.41
▸ MEN1 O00255 3/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ CYP2D6 P10635 1/20 0.41
▸ KDM4E B2RXH2 4/20 0.38
▸ POLB P06746 2/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ PPARD Q03181 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ ALDH1A1 P00352 3/20 0.38
▸ HTT P42858 1/20 0.38
▸ TSHR P16473 1/20 0.37
▸ TRPV1 Q8NER1 1/20 0.37
▸ KCNN4 O15554 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
SCHEMBL5691818 0.88 PPARG (0.61) PPARGPPARAKMT2AMAPTCYP2C19
SCHEMBL27638956 0.85 PPARG (0.59) PPARGPPARAKMT2AMAPTCYP2C19
SCHEMBL11599887 0.85 PPARA (0.68) PPARGPPARAKMT2AMAPTCYP2C19
SCHEMBL11602527 0.83 PPARA (0.58) PPARGPPARAKMT2AMAPTCYP2C19
SCHEMBL11600576 0.83 PPARA (0.62) PPARGPPARAKMT2AMAPTCYP2C19
SCHEMBL11394121 0.83 PPARA (0.58) PPARGPPARAKMT2AMAPTCYP2C19
SCHEMBL11601984 0.80 PPARA (0.54) PPARGPPARAKMT2AMAPTCYP2C19
SCHEMBL11600039 0.80 PPARA (0.61) PPARGPPARAKMT2AMAPTCYP2C19
SCHEMBL11601202 0.80 PPARG (0.54) PPARGPPARAKMT2AMEN1PPARD
SCHEMBL11600781 0.80 PPARA (0.57) PPARGPPARAKMT2AMAPTCYP2C19

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
EP-1106639-B1 PHOTOCURABLE COMPOSITION CONTAINING IODONIUM SALT COMPOUND NIPPON SODA CO (JP) 2007-08-29 — — EP disclosed
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