SCHEMBL4504773

SCHEMBL4504773

C/C(=C/C(=O)O)c1cc2cccc(OC(C)c3ccccc3)c2o1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 5/20 0.52
RARA P10276 1/20 0.49
RXRB P28702 2/20 0.48
RXRG P48443 2/20 0.48
LMNA P02545 1/20 0.47
RECQL P46063 1/20 0.47
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
LTB4R Q15722 5/20 0.43
LTB4R2 Q9NPC1 5/20 0.43
ALDH1A1 P00352 2/20 0.43
MAPT P10636 2/20 0.40
RORC P51449 2/20 0.40
HTT P42858 2/20 0.40
ADORA3 P0DMS8 1/20 0.40
ADORA2A P29274 1/20 0.40
ADORA1 P30542 1/20 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
SCHEMBL4504776 1.00 RXRA (0.52) RXRARARARXRBRXRGLMNA
SCHEMBL4504774 1.00 RXRA (0.52) RXRARARARXRBRXRGLMNA
SCHEMBL4354326 0.87 LMNA (0.63) LMNARECQLKMT2AMEN1NPC1
SCHEMBL4352255 0.87 LTB4R (0.63) RXRARARALMNARECQLLTB4R
SCHEMBL4352260 0.87 LTB4R (0.63) RXRARARALMNARECQLLTB4R
SCHEMBL4503302 0.85 LTB4R (0.46) RXRARARARXRBRXRGLMNA
SCHEMBL4503296 0.85 LTB4R (0.46) RXRARARARXRBRXRGLMNA
SCHEMBL4503299 0.85 LTB4R (0.46) RXRARARARXRBRXRGLMNA
SCHEMBL13600969 0.83 MEN1 (0.46) LMNARECQLKMT2AMEN1NPC1
SCHEMBL13600982 0.83 MAPT (0.46) LMNARECQLKMT2AMEN1NPC1

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-7638540-B2 Benzofuran compound and medicinal composition containing the same THE NEW INDUSTRY RESEARCH ORGANIZATION (JP) 2009-12-29 US disclosed
US-20060194851-A1 Benzofuran compound and medicinal composition containing the same NEW INDUSTRY RESEARCH ORGANIZATION, THE (JP) 2006-08-31 US disclosed
EP-1627873-A1 BENZOFURAN COMPOUND AND MEDICINAL COMPOSITION CONTAINING THE SAME The New Industry Research Organization (JP) 2006-02-22 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-20060194851-A1 Benzofuran compound and medicinal composition containing the same LTB4R2, LTC4S, LTB4R RXRA 4558/4885RARA 4392/4885RXRB 4430/4885

“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.