SCHEMBL202603

SCHEMBL202603

O=C(NOCc1ccccc1)C1SCCN1C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 7/20 0.44
RAB9A P51151 7/20 0.44
EPHX2 P34913 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.39
GPR183 P32249 1/20 0.38
PREP P48147 1/20 0.38
CFD P00746 1/20 0.38
HDAC3 O15379 1/20 0.38
NCOR2 Q9Y618 1/20 0.38
CYP2C19 P33261 1/20 0.37

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
SCHEMBL201381 0.85 STS (0.43) NPC1RAB9ASMN1; SMN2
SCHEMBL201382 0.85 STS (0.43) NPC1RAB9ASMN1; SMN2
SCHEMBL201387 0.83 SPHK2 (0.44) NPC1RAB9ASMN1; SMN2
SCHEMBL201386 0.83 SPHK2 (0.44) NPC1RAB9ASMN1; SMN2
SCHEMBL203188 0.79 HCRTR1 (0.45)
SCHEMBL201557 0.78 HCRTR1 (0.41) NPC1RAB9AGPR183
SCHEMBL202498 0.77 MTTP (0.45)
SCHEMBL201123 0.77 LMNA (0.37)
SCHEMBL201235 0.73 NPC1 (0.46) NPC1RAB9AEPHX2SMN1; SMN2HDAC3
SCHEMBL10941237 0.72 NPC1 (0.53) NPC1RAB9ASMN1; SMN2PREPCYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8088804-B2 N-hydroxyamide derivatives possessing antibacterial activity PFIZER INC. (US) 2012-01-03 US disclosed
EP-2338878-A2 N-hydroxyamide derivatives possessing antibacterial activity Vicuron Pharmaceuticals, Inc. (US) 2011-06-29 EP disclosed
US-20100022605-A1 N-HYDROXYAMIDE DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY VICURON PHARMACEUTICALS INC. 2010-01-28 US disclosed
EP-1963262-A2 N-HYDROXYAMIDE DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY Vicuron Pharmaceuticals, Inc. (US) 2008-09-03 EP disclosed
WO-2007069020-A2 N-HYDROXYAMIDE DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY VICURON PHARMACEUTICALS INC. (US) 2007-06-21 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-20100022605-A1 N-HYDROXYAMIDE DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY NAAA, HDHD5, HACL2 NPC1 1027/4885RAB9A 940/4885EPHX2 1565/4885

“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.