SCHEMBL7043377

SCHEMBL7043377

Cc1cccc(CS(=O)(=O)C(CNC(=O)c2ccsc2)C(=O)NCCC(C(=O)c2nc3ccccc3o2)c2ccccc2)n1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
GART P22102 1/20 0.33
ITGAV P06756 1/20 0.32
CTSS P25774 12/20 0.32
CYP3A4 P08684 1/20 0.31
CYP2C9 P11712 1/20 0.31
TP53 P04637 1/20 0.31
SLC6A9 P48067 1/20 0.31
SLC6A5 Q9Y345 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
SCHEMBL6468407 0.90 EPHX2 (0.38) NPC1RAB9AGARTCTSSCYP3A4
SCHEMBL7043354 0.83 EPHX2 (0.39) NPC1RAB9AGARTCTSSCYP3A4
SCHEMBL7179327 0.82 LMNA (0.38) CTSSCYP3A4CYP2C9
SCHEMBL7042145 0.82 CTSS (0.40) CTSSCYP3A4CYP2C9
SCHEMBL6468432 0.80 GART (0.34) NPC1RAB9AGARTCTSSCYP3A4
SCHEMBL6464414 0.79 FAAH (0.38) GARTCTSSCYP3A4CYP2C9
SCHEMBL7049143 0.77 HTT (0.34) RAB9ACTSSCYP3A4CYP2C9
SCHEMBL7183010 0.76 CTSS (0.37) CTSSCYP3A4CYP2C9
SCHEMBL6465509 0.75 LMNA (0.46) CTSSCYP3A4
SCHEMBL7049525 0.74 GART (0.38) GARTCTSSCYP3A4CYP2C9

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 NPC1 428/4885RAB9A 1895/4885GART 2659/4885

“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.