SCHEMBL5332771

SCHEMBL5332771

COC(=O)c1ccccc1C=Cc1ccc(OC)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.59
SNCA P37840 8/20 0.58
RELA Q04206 3/20 0.56
NFE2L2 Q16236 2/20 0.56
TRPA1 O75762 2/20 0.54
MAPT P10636 3/20 0.54
MAOB P27338 2/20 0.54
CYP2D6 P10635 1/20 0.54
CYP2C9 P11712 1/20 0.54
MAOA P21397 1/20 0.54
CYP2C19 P33261 1/20 0.54
CASP3 P42574 1/20 0.54
SENP8 Q96LD8 1/20 0.54
SENP7 Q9BQF6 1/20 0.54
SENP6 Q9GZR1 1/20 0.54
GSK3B P49841 1/20 0.51
NPC1 O15118 2/20 0.51
LMNA P02545 1/20 0.51
MEN1 O00255 1/20 0.51
RAB9A P51151 1/20 0.51

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
SCHEMBL5343618 1.00 BACE1 (0.59) BACE1SNCARELANFE2L2TRPA1
SCHEMBL30423635 0.87 BACE1 (0.61) BACE1SNCANFE2L2TRPA1MAPT
SCHEMBL29227737 0.87 BACE1 (0.61) BACE1SNCANFE2L2TRPA1MAPT
SCHEMBL2658196 0.87 BACE1 (0.61) BACE1SNCANFE2L2TRPA1MAPT
SCHEMBL2658197 0.87 BACE1 (0.61) BACE1SNCANFE2L2TRPA1MAPT
SCHEMBL5335032 0.86 TRPA1 (0.61) SNCARELANFE2L2TRPA1MAPT
SCHEMBL5335033 0.86 TRPA1 (0.61) SNCARELANFE2L2TRPA1MAPT
SCHEMBL69552 0.85 BACE1 (0.60) BACE1MAPTLMNAKMT2ASMN1; SMN2
SCHEMBL69553 0.85 BACE1 (0.60) BACE1MAPTLMNAKMT2ASMN1; SMN2
SCHEMBL29054162 0.85 BACE1 (0.59) BACE1SNCAMAPTCYP2C19LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7309718-B2 Dibenzocycloheptene compound UBE INDUSTRIES, LTD. (JP) 2007-12-18 US disclosed
US-20040180884-A1 Dibenzocycloheptene compound UBE INDUSTRIES, LTD. (JP) 2004-09-16 US disclosed
EP-1408033-A1 DIBENZOCYCLOHEPTENE COMPOUND Ube Industries, Ltd. (JP) 2004-04-14 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040180884-A1 Dibenzocycloheptene compound LTB4R2, LTA4H, LTC4S BACE1 1846/4885SNCA 4503/4885RELA 935/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.