SCHEMBL200902

SCHEMBL200902

COC[C@@]1(O)C[C@@H](C(=O)O)N(C(=O)OCc2ccccc2)C1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PREP P48147 5/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
HTR2C P28335 1/20 0.43
NPSR1 Q6W5P4 1/20 0.42
PSEN1 P49768 1/20 0.42
PSEN2 P49810 1/20 0.42
APH1B Q8WW43 1/20 0.42
NCSTN Q92542 1/20 0.42
APH1A Q96BI3 1/20 0.42
PSENEN Q9NZ42 1/20 0.42
MITF O75030 1/20 0.42
MAPT P10636 1/20 0.42
HTT P42858 1/20 0.42

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
SCHEMBL203202 0.91 HTT (0.49) PREPNPC1RAB9ASMN1; SMN2HTR2C
SCHEMBL203203 0.91 HTT (0.49) PREPNPC1RAB9ASMN1; SMN2HTR2C
SCHEMBL10987242 0.89 NPC1 (0.45) PREPNPC1RAB9ASMN1; SMN2HTR2C
SCHEMBL10987285 0.88 SMN1; SMN2 (0.46) PREPNPC1RAB9ASMN1; SMN2HTR2C
SCHEMBL11231397 0.86 RAB9A (0.44) PREPNPC1RAB9ASMN1; SMN2HTR2C
SCHEMBL10990253 0.84 SMN1; SMN2 (0.47) PREPNPC1RAB9ASMN1; SMN2HTR2C
SCHEMBL14762396 0.84 SMN1; SMN2 (0.47) PREPNPC1RAB9ASMN1; SMN2HTR2C
SCHEMBL10989802 0.84 SMN1; SMN2 (0.45) PREPNPC1RAB9ASMN1; SMN2HTR2C
SCHEMBL10984991 0.84 NPC1 (0.43) PREPNPC1RAB9ASMN1; SMN2HTR2C
SCHEMBL10987961 0.84 ELANE (0.44) PREPNPC1RAB9ASMN1; SMN2HTR2C

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 PREP 1246/4885NPC1 1027/4885RAB9A 940/4885

“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.