SCHEMBL7543059

SCHEMBL7543059

C=CC(=O)Oc1ccc(C=CC(=O)c2ccccc2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.66
BCHE P06276 2/20 0.66
NFKB1 P19838 2/20 0.66
NFKB2 Q00653 2/20 0.66
RELA Q04206 2/20 0.66
MAPT P10636 6/20 0.62
MAOB P27338 4/20 0.62
LMNA P02545 3/20 0.62
TNFRSF1A P19438 2/20 0.62
CYP1B1 Q16678 2/20 0.62
PLIN1 O60240 1/20 0.62
ACHE P22303 1/20 0.62
RECQL P46063 1/20 0.62
PLIN5 Q00G26 1/20 0.62
ABHD5 Q8WTS1 1/20 0.62
KMT2A Q03164 4/20 0.61
RAB9A P51151 3/20 0.61
NPC1 O15118 2/20 0.61
HSPD1 P10809 2/20 0.59
HSPE1 P61604 2/20 0.59

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
SCHEMBL7543053 1.00 CYP3A4 (0.66) CYP3A4BCHENFKB1NFKB2RELA
SCHEMBL10867827 0.94 CYP1B1 (0.66) CYP3A4BCHENFKB1NFKB2RELA
SCHEMBL38652058 0.92 F3 (0.63) CYP3A4BCHENFKB1NFKB2RELA
SCHEMBL20828533 0.92 F3 (0.63) CYP3A4BCHENFKB1NFKB2RELA
SCHEMBL13840001 0.88 BCHE (0.52) CYP3A4BCHENFKB1NFKB2RELA
SCHEMBL16174211 0.86 CYP3A4 (0.71) CYP3A4BCHENFKB1NFKB2RELA
SCHEMBL8964970 0.85 MAOB (0.69) CYP3A4BCHEMAPTMAOBLMNA
SCHEMBL8964978 0.85 MAOB (0.69) CYP3A4BCHEMAPTMAOBLMNA
SCHEMBL5068764 0.84 KMT2A (0.71) NFKB1NFKB2RELAMAPTMAOB
SCHEMBL5068765 0.84 KMT2A (0.71) NFKB1NFKB2RELAMAPTMAOB

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-0718694-B1 Radiation-curable composition JAPAN SYNTHETIC RUBBER CO LTD (JP) 2002-05-15 EP disclosed
EP-0718694-A2 Radiation-curable composition JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1996-06-26 EP disclosed