SCHEMBL6130744

SCHEMBL6130744

CCCCCC1(CCCCC)Cc2c(cc(C)c(O)c2C)O1

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 4/20 0.38
SIRT2 Q8IXJ6 1/20 0.33
TRPV1 Q8NER1 3/20 0.32
ESR1 P03372 2/20 0.31
CNR2 P34972 1/20 0.30

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
Bo-653 SCHEMBL5055886 0.74 PTPN1 (0.36) PTPN1SIRT2TRPV1
SCHEMBL5479201 0.73 PTPN1 (0.37) PTPN1SIRT2TRPV1
SCHEMBL5474064 0.73 PTPN1 (0.37) PTPN1SIRT2TRPV1
SCHEMBL5474046 0.73 PTPN1 (0.37) PTPN1SIRT2TRPV1
SCHEMBL5471648 0.73 PTPN1 (0.37) PTPN1SIRT2TRPV1
SCHEMBL6130778 0.72 ALDH1A1 (0.38) PTPN1
SCHEMBL7066288 0.69 AKT1 (0.43) PTPN1ESR1
SCHEMBL6767599 0.65 PTPN1 (0.37) PTPN1SIRT2
SCHEMBL6130741 0.64 CYP2D6 (0.40) SIRT2
SCHEMBL2481913 0.64 CTSB (0.39)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050159476-A1 Pharmaceutical composition for preventing or treating respiratory disease CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2005-07-21 US disclosed
EP-1490048-A4 PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING RESPIRATORY DISEASE CHUGAI PHARMACEUTICAL CO LTD (JP) 2005-06-01 EP disclosed
EP-1490048-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING RESPIRATORY DISEASE CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2004-12-29 EP disclosed
WO-2003082264-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING RESPIRATORY DISEASE CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2003-10-09 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-20050159476-A1 Pharmaceutical composition for preventing or treating respiratory disease CFTR, CMA1, SLC5A1 PTPN1 1800/4885SIRT2 1321/4885TRPV1 1538/4885

“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.