SCHEMBL8284595

SCHEMBL8284595

CC[C@H](NC(=O)[C@H](CS(=O)(=O)CC1CC1)NC1=NS(=O)(=O)c2ccccc21)C(=O)c1nc(-c2ccccc2)no1

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.33
RAB9A P51151 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
HPGD P15428 1/20 0.33
LMNA P02545 2/20 0.32
ALDH1A1 P00352 2/20 0.32
KMT2A Q03164 2/20 0.32
GAA P10253 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
HSD17B10 Q99714 1/20 0.32
MAPT P10636 1/20 0.31

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
SCHEMBL14507959 0.87 RAB9A (0.38) SMN1; SMN2RAB9ANPSR1HPGDALDH1A1
SCHEMBL8283341 0.87 ALDH1A1 (0.39) SMN1; SMN2RAB9ANPSR1HPGDALDH1A1
SCHEMBL8284114 0.86 HSD17B10 (0.33) SMN1; SMN2RAB9ANPSR1HPGDLMNA
SCHEMBL8284881 0.85 LMNA (0.34) SMN1; SMN2RAB9ANPSR1HPGDLMNA
SCHEMBL8284130 0.85 CTSS (0.43)
SCHEMBL14507994 0.85 SMN1; SMN2 (0.34) SMN1; SMN2RAB9AHPGDLMNAALDH1A1
SCHEMBL8284128 0.84 LMNA (0.33) SMN1; SMN2RAB9ANPSR1HPGDLMNA
SCHEMBL8283325 0.84 SMN1; SMN2 (0.34) SMN1; SMN2RAB9ANPSR1HPGDLMNA
SCHEMBL8284006 0.83 ALDH1A1 (0.35) SMN1; SMN2RAB9ANPSR1HPGDLMNA
SCHEMBL8283337 0.82 NPPA (0.34) SMN1; SMN2RAB9ANPSR1HPGDLMNA

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
US-20070105892-A1 Amidino compounds as cysteine protease inhibitors AXYS PHARMACEUTICALS, INC. (US) 2007-05-10 US disclosed
US-20070105892-A1 Amidino compounds as cysteine protease inhibitors AXYS PHARMACEUTICALS, INC. (US) 2007-05-10 US disclosed
WO-2005063742-A2 AMIDINO COMPOUNDS AS CYSTEINE PROTEASE INHIBITORS AXYS PHARMACEUTICALS, INC. (US) 2005-07-14 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-20070105892-A1 Amidino compounds as cysteine protease inhibitors CTSF, CTSB, CTSS SMN1; SMN2 4478/4885RAB9A 966/4885NPSR1 1892/4885

“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.