SCHEMBL6467035

SCHEMBL6467035

O=C(NCC(C(=O)NCC(O)(CCc1ccccc1)c1nc2ccccc2o1)C1CCCCC1)C1CCN(C(=O)O)CC1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.47
MAPT P10636 5/20 0.47
SMN1; SMN2 Q16637 3/20 0.41
TSHR P16473 2/20 0.41
HTT P42858 2/20 0.41
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 3/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
NPSR1 Q6W5P4 1/20 0.37
TP53 P04637 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36

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
SCHEMBL7048360 0.92 HTT (0.45) LMNAMAPTSMN1; SMN2TSHRHTT
SCHEMBL7043453 0.90 LMNA (0.43) LMNAMAPTSMN1; SMN2TSHRHTT
SCHEMBL6466282 0.87 LMNA (0.39) LMNAMAPTSMN1; SMN2TSHRHTT
SCHEMBL7045974 0.86 CTSS (0.43) LMNAMAPTSMN1; SMN2TSHRHTT
SCHEMBL7047935 0.84 LMNA (0.37) LMNAMAPTSMN1; SMN2TSHRHTT
SCHEMBL7049029 0.82 RAB9A (0.38) LMNAMAPTSMN1; SMN2TSHRKMT2A
SCHEMBL7046906 0.76 MAPT (0.43) LMNAMAPTSMN1; SMN2TSHRHTT
SCHEMBL6464160 0.76 LMNA (0.39) LMNAMAPTSMN1; SMN2TSHRHTT
SCHEMBL7045443 0.74 MEN1 (0.45) LMNAMAPTSMN1; SMN2TSHRKMT2A
SCHEMBL7044868 0.73 LMNA (0.37) LMNAMAPTSMN1; SMN2TSHRHTT

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-1516877-A1 Amine derivatives as protease inhibitors AXYS PHARMACEUTICALS, INC. (US) 2005-03-23 EP disclosed
US-20030232864-A1 Novel Compounds and compositions as protease inhibitors AXYS PHARMACEUTICALS, INC. (US) 2003-12-18 US disclosed
US-6576630-B1 Alkanoyl substituted benzooxazoles or naphthooxazoles AXYS PHARMACEUTICALS, INC. 2003-06-10 US 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-20030232864-A1 Novel Compounds and compositions as protease inhibitors SERPINB1, CTRL, CTSZ LMNA 1755/4885MAPT 2414/4885SMN1; SMN2 4034/4885

“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.