SCHEMBL4495014

SCHEMBL4495014

O=C(/C=C/c1ccccc1)Nc1c(C(=O)O)oc2ccccc12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.58
TP53 P04637 1/20 0.52
POLB P06746 1/20 0.52
KMT2A Q03164 3/20 0.52
MEN1 O00255 2/20 0.52
LMNA P02545 2/20 0.52
PKM P14618 1/20 0.52
MMP1 P03956 7/20 0.51
MMP2 P08253 7/20 0.51
MMP9 P14780 7/20 0.51
EGFR P00533 6/20 0.51
MAOA P21397 3/20 0.51
MAOB P27338 2/20 0.51
ALDH1A1 P00352 2/20 0.48
TSHR P16473 1/20 0.48
HDAC3 O15379 1/20 0.47
HDAC4 P56524 1/20 0.47
HDAC1 Q13547 1/20 0.47
HDAC2 Q92769 1/20 0.47
HDAC8 Q9BY41 1/20 0.47

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
SCHEMBL4495023 1.00 SMN1; SMN2 (0.58) SMN1; SMN2TP53POLBKMT2AMEN1
SCHEMBL4496337 0.85 SMN1; SMN2 (0.63) SMN1; SMN2TP53POLBKMT2AMEN1
SCHEMBL13600934 0.83 LMNA (0.65) SMN1; SMN2KMT2AMEN1LMNAALDH1A1
SCHEMBL6857800 0.79 TSHR (0.62) SMN1; SMN2POLBKMT2AMEN1LMNA
SCHEMBL2774243 0.77 TSHR (0.76) SMN1; SMN2TP53POLBKMT2AMEN1
SCHEMBL4492601 0.76 ALDH1A1 (0.54) SMN1; SMN2TP53KMT2AMEN1LMNA
SCHEMBL4492607 0.76 ALDH1A1 (0.54) SMN1; SMN2TP53KMT2AMEN1LMNA
SCHEMBL29097701 0.75 CA12 (0.59) SMN1; SMN2POLBKMT2AMEN1MMP1
SCHEMBL29097702 0.75 CA12 (0.59) SMN1; SMN2POLBKMT2AMEN1MMP1
SCHEMBL4510297 0.74 MMP1 (0.54) SMN1; SMN2POLBKMT2AMEN1LMNA

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 5 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-7638540-B2 Benzofuran compound and medicinal composition containing the same THE NEW INDUSTRY RESEARCH ORGANIZATION (JP) 2009-12-29 US disclosed
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 SMN1; SMN2 2975/4885TP53 3460/4885POLB 3626/4885

“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.