SCHEMBL6003798

SCHEMBL6003798

CCOC(=O)CCCCCNC(=O)n1ccc(C(=O)Nc2c(C)cccc2OC)n1

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 3/20 0.63
NAMPT P43490 3/20 0.45
KMT2A Q03164 2/20 0.44
F2 P00734 1/20 0.44
ALDH1A1 P00352 2/20 0.41
USP2 O75604 1/20 0.37
HSD17B10 Q99714 1/20 0.37
S1PR2 O95136 1/20 0.37
S1PR4 O95977 1/20 0.37
S1PR1 P21453 1/20 0.37
S1PR3 Q99500 1/20 0.37
S1PR5 Q9H228 1/20 0.37
NLRP3 Q96P20 1/20 0.35
PDE5A O76074 1/20 0.35
TNF P01375 1/20 0.35

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
SCHEMBL6002505 0.82 ALOX15 (0.62) ALOX15NAMPTKMT2AALDH1A1USP2
SCHEMBL6004843 0.78 ALOX15 (0.69) ALOX15NAMPTKMT2AF2ALDH1A1
SCHEMBL6002607 0.77 ALOX15 (0.65) ALOX15NAMPTKMT2AALDH1A1
SCHEMBL6003810 0.76 ALOX15 (0.53) ALOX15NAMPTKMT2AALDH1A1USP2
SCHEMBL6004193 0.75 ALOX15 (0.73) ALOX15NAMPTKMT2AALDH1A1
SCHEMBL6004374 0.74 ALOX15 (0.61) ALOX15NAMPTKMT2AALDH1A1USP2
SCHEMBL6003826 0.73 ALOX15 (0.67) ALOX15NAMPTKMT2AF2ALDH1A1
SCHEMBL3915623 0.73 ALOX15 (0.65) ALOX15NAMPTKMT2AALDH1A1HSD17B10
SCHEMBL23002371 0.67 SMN1; SMN2 (0.59) ALOX15KMT2AF2ALDH1A1
SCHEMBL23002439 0.65 RAB9A (0.66) ALOX15KMT2AF2ALDH1A1S1PR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060183780-A1 Pyrazole compounds useful in the treatment of inflammation BIOLIPOX AB (SE) 2006-08-17 US disclosed
EP-1603897-A1 PYRAZOLE COMPOUNDS USEFUL IN THE TREATMENT OF INFLAMMATION Biolipox AB (SE) 2005-12-14 EP disclosed
WO-2004080999-A1 PYRAZOLE COMPOUNDS USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2004-09-23 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-20060183780-A1 Pyrazole compounds useful in the treatment of inflammation ALOX15, ALOX12, ALOX15B ALOX15 1/4885NAMPT 1461/4885KMT2A 4358/4885

“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.