SCHEMBL5883528

SCHEMBL5883528

O=CCCCCc1ncccn1

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.43
HIF1A Q16665 1/20 0.38
TSHR P16473 2/20 0.34
TRPV1 Q8NER1 2/20 0.32
FAAH O00519 2/20 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
SCHEMBL4087934 0.93 NAAA (0.40) NAAAHIF1ATSHR
SCHEMBL348397 0.84 NAAA (0.34) NAAAHIF1A
SCHEMBL24259322 0.78 ALDH1A1 (0.34) HIF1ATSHR
SCHEMBL29263731 0.76 HRH1 (0.58) NAAA
SCHEMBL29263644 0.75 HRH1 (0.61) NAAA
SCHEMBL7036030 0.75 NAAA (0.47) NAAA
SCHEMBL7465934 0.74 HIF1A (0.33) HIF1ATSHR
SCHEMBL1258644 0.72 NAAA (0.44) NAAA
SCHEMBL29104167 0.72 NAAA (0.48) NAAATSHR
SCHEMBL6168562 0.71 HDAC2 (0.46) NAAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060287338-A1 Metalloproteinase inhibitor compounds ASTRAZENECA AB (SE) 2006-12-21 US disclosed
US-7122551-B2 Metalloproteinase inhibitor compounds ASTRAZENECA AB (SE) 2006-10-17 US disclosed
CN-1247547-C Piperidine and piperazine substituted N-hydroxyformamides as inhibitors of metalloproteinases ASTRAZENECA AB (SE) 2006-03-29 CN disclosed
US-20040176386-A1 Compounds ASTRAZENECA AB (SE) 2004-09-09 US disclosed
US-6734183-B2 USEFUL AS METALLOPROTEINASE INHIBITOR; PIPERAZINO-SULFONAMIDE OR PIPERIDINO-SULFONAMIDE COMPOUND ASTRAZENECA AB (SE) 2004-05-11 US disclosed
CN-1418197-A Piperidine and piperazine substituted N-hydroxycarboxamides as metalloproteinase inhibitors ASTRAZENECA AB (SE) 2003-05-14 CN disclosed
EP-1261590-A1 PIPERIDINE- AND PIPERAZINE SUBSTITUTED N-HYDROXYFORMAMIDES AS INHIBITORS OF METALLOPROTEINASES AstraZeneca AB (SE) 2002-12-04 EP disclosed
US-20020022628-A1 Compounds ASTRAZENECA AB (SE) 2002-02-21 US disclosed
WO-2001062742-A1 PIPERIDINE- AND PIPERAZINE SUBSTITUTED N-HYDROXYFORMAMIDES AS INHIBITORS OF METALLOPROTEINASES ASTRAZENECA AB (SE) 2001-08-30 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 (3 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-20020022628-A1 Compounds MMP13, MMP11, MMP3 NAAA 1907/4885HIF1A 906/4885TSHR 4597/4885
US-20060287338-A1 Metalloproteinase inhibitor compounds TIMP3, MMP2, MMP13 NAAA 1165/4885HIF1A 1188/4885TSHR 4551/4885
US-20040176386-A1 Compounds MMP13, MMP11, MMP3 NAAA 1907/4885HIF1A 906/4885TSHR 4597/4885

“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.