SCHEMBL4516304

SCHEMBL4516304

CCNS(=O)(=O)c1ccc(OCCCC(=O)OCC)c2oc(C(C)NC(=O)c3cnoc3C)cc12

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ACACB O00763 6/20 0.34
CNR2 P34972 2/20 0.32
F2RL3 Q96RI0 1/20 0.31
HPGD P15428 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
PTPN1 P18031 1/20 0.30
USP2 O75604 1/20 0.30
ALDH1A1 P00352 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL4491377 0.65 CNR2 (0.44) ACACBCNR2
SCHEMBL8810166 0.63 CYP1A2 (0.50) HPGDSMN1; SMN2USP2ALDH1A1TSHR
SCHEMBL10646948 0.58 MAPT (0.46) CNR2HPGDALDH1A1
SCHEMBL10649875 0.57 FABP4 (0.40) CNR2
SCHEMBL4497419 0.56 LMNA (0.57) CNR2F2RL3SMN1; SMN2PTPN1ALDH1A1
SCHEMBL2654920 0.56 FDPS (0.44) HPGDSMN1; SMN2TDP1L3MBTL1ALDH1A1
SCHEMBL17821696 0.56 FDPS (0.58) HPGDSMN1; SMN2TDP1L3MBTL1ALDH1A1
SCHEMBL7367306 0.56 FDPS (0.67) HPGDSMN1; SMN2ALDH1A1TSHR
SCHEMBL9392426 0.55 LMNA (0.53) HPGDSMN1; SMN2L3MBTL1ALDH1A1TSHR
SCHEMBL12588907 0.55 L3MBTL1 (0.39) SMN1; SMN2TDP1L3MBTL1USP2ALDH1A1

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 ACACB 1863/4885CNR2 514/4885F2RL3 364/4885

“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.