SCHEMBL201235

SCHEMBL201235

O=C(NOCc1ccccc1)C1C=CCN1C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 7/20 0.46
RAB9A P51151 7/20 0.46
EPHX2 P34913 2/20 0.41
PSEN1 P49768 2/20 0.40
PSEN2 P49810 2/20 0.40
APH1B Q8WW43 2/20 0.40
NCSTN Q92542 2/20 0.40
APH1A Q96BI3 2/20 0.40
PSENEN Q9NZ42 2/20 0.40
HDAC3 O15379 1/20 0.38
NCOR2 Q9Y618 1/20 0.38
PIN1 Q13526 1/20 0.37
SMN1; SMN2 Q16637 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
SCHEMBL200968 0.85 GHSR (0.41) NPC1RAB9APSEN1PSEN2APH1B
SCHEMBL200967 0.85 GHSR (0.41) NPC1RAB9APSEN1PSEN2APH1B
SCHEMBL249943 0.80 HPGD (0.50)
SCHEMBL200777 0.73 NPC1 (0.44) NPC1RAB9AEPHX2SMN1; SMN2
SCHEMBL202603 0.73 NPC1 (0.44) NPC1RAB9AEPHX2HDAC3NCOR2
SCHEMBL28309401 0.72 NPC1 (0.57) NPC1RAB9AEPHX2SMN1; SMN2
SCHEMBL13291997 0.71 PSEN1 (0.57) NPC1RAB9APSEN1PSEN2APH1B
SCHEMBL15541150 0.71 PSEN1 (0.57) NPC1RAB9APSEN1PSEN2APH1B
SCHEMBL201385 0.71 NPC1 (0.43) NPC1RAB9AEPHX2HDAC3NCOR2
SCHEMBL29510652 0.70 PSEN1 (0.56) NPC1RAB9APSEN1PSEN2APH1B

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.