SCHEMBL5734820

SCHEMBL5734820

COC(=O)C1(O)COc2ccc(OC)cc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.43
MEN1 O00255 2/20 0.43
SMN1; SMN2 Q16637 3/20 0.42
TSHR P16473 2/20 0.42
ALDH1A1 P00352 1/20 0.42
MAPT P10636 1/20 0.42
MTNR1A P48039 3/20 0.40
TP53 P04637 2/20 0.40
GAA P10253 1/20 0.40
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 0.40
NPSR1 Q6W5P4 1/20 0.40
SHMT2 P34897 1/20 0.39
F10 P00742 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
HTR1A P08908 1/20 0.39
HTR2B P41595 1/20 0.39
SIGMAR1 Q99720 1/20 0.39
PKM P14618 1/20 0.39
NFKB1 P19838 1/20 0.39

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
SCHEMBL6578320 0.86 SMN1; SMN2 (0.42) KMT2AMEN1SMN1; SMN2TSHRALDH1A1
SCHEMBL5736873 0.83 HTT (0.40) KMT2AMEN1SMN1; SMN2TSHRMAPT
SCHEMBL6580916 0.76 RAB9A (0.43) KMT2AMEN1SMN1; SMN2TSHRALDH1A1
SCHEMBL9832996 0.75 HTR2B (0.46) SMN1; SMN2ALDH1A1MAPTGAANPC1
SCHEMBL19469567 0.74 SMN1; SMN2 (0.47) KMT2AMEN1SMN1; SMN2TSHRALDH1A1
SCHEMBL11455838 0.73 HTR2B (0.48) HTR1AHTR2BSIGMAR1
SCHEMBL7032960 0.72 HTR2B (0.42) KMT2AMEN1ALDH1A1MAPTGAA
SCHEMBL31432548 0.71 SCN9A (0.40) KMT2ASMN1; SMN2ALDH1A1MAPTMTNR1A
SCHEMBL7177095 0.69 AKR1B1 (0.55) ALDH1A1MAPTGAANPC1RAB9A
SCHEMBL28608472 0.69 SMN1; SMN2 (0.50) KMT2AMEN1SMN1; SMN2ALDH1A1MTNR1A

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
EP-1644364-A1 TETRAZOL BENZOFURANCARBOXAMIDES WITH PI3K ACTIVITY AS THERAPEUTIC AGENTS Warner-Lambert Company LLC (US) 2006-04-12 EP disclosed
US-20050020631-A1 3-Substituted benzofurans as therapeutic agents GOGLIOTTI ROCCO DEAN (US) 2005-01-27 US disclosed
WO-2004108709-A1 TETRAZOL BENZOFURANCARBOXAMIDES WITH P13K AKTIVITY AS THERAPEUTIC AGENTS WARNER-LAMBERT COMPANY LLC (US) 2004-12-16 WO 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-20050020631-A1 3-Substituted benzofurans as therapeutic agents CYP4F11, BPTF, F3 KMT2A 3196/4885MEN1 1438/4885SMN1; SMN2 2260/4885

“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.