SCHEMBL7044864

SCHEMBL7044864

CC(CCNC(=O)OCc1ccccc1)CC(=O)NCCC(C(=O)c1cccs1)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 1/20 0.41
SLC1A1 P43005 1/20 0.41
LMNA P02545 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
HTT P42858 1/20 0.39
POLB P06746 1/20 0.39
CYP3A4 P08684 1/20 0.39
MEN1 O00255 1/20 0.39
TSHR P16473 1/20 0.39
KMT2A Q03164 1/20 0.39
HPGD P15428 2/20 0.39
KCNA5 P22460 1/20 0.38

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
SCHEMBL6062401 0.85 L3MBTL1 (0.40) SLC1A3SLC1A1LMNASMN1; SMN2L3MBTL1
SCHEMBL7043168 0.82 MAPK1 (0.48) SLC1A3SLC1A1LMNASMN1; SMN2L3MBTL1
SCHEMBL6465943 0.81 ANPEP (0.44) SLC1A3SLC1A1LMNASMN1; SMN2L3MBTL1
SCHEMBL6063445 0.79 PTGER4 (0.47) SLC1A3SLC1A1LMNASMN1; SMN2L3MBTL1
SCHEMBL7799710 0.79 SLC1A3 (0.42) SLC1A3SLC1A1LMNASMN1; SMN2L3MBTL1
SCHEMBL7046317 0.79 SLC1A3 (0.39) SLC1A3SLC1A1LMNASMN1; SMN2L3MBTL1
SCHEMBL7043362 0.79 KCNA5 (0.39) SLC1A3SLC1A1LMNASMN1; SMN2L3MBTL1
SCHEMBL7046968 0.79 ELANE (0.44) SLC1A3SLC1A1LMNASMN1; SMN2L3MBTL1
SCHEMBL7790161 0.77 LMNA (0.46) SLC1A3SLC1A1LMNASMN1; SMN2L3MBTL1
SCHEMBL7046899 0.77 CYP3A4 (0.39) SLC1A3SLC1A1LMNASMN1; SMN2L3MBTL1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 SLC1A3 4389/4885SLC1A1 4414/4885LMNA 1755/4885

“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.