SCHEMBL6282811

SCHEMBL6282811

CCCCCCOc1ccc(CCn2c(C)ccc2-c2ccc(O)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR5A1 Q13285 1/20 0.55
LTA4H P09960 2/20 0.49
ADORA3 P0DMS8 3/20 0.44
SLC6A2 P23975 3/20 0.44
CHRM1 P11229 2/20 0.44
PTGS1 P23219 2/20 0.44
PGR P06401 1/20 0.44
TBXA2R P21731 1/20 0.44
PDE4A P27815 1/20 0.44
ADRA1A P35348 1/20 0.44
DRD3 P35462 1/20 0.44
ESR1 P03372 3/20 0.43
CYP3A4 P08684 3/20 0.43
TP53 P04637 3/20 0.43
ADRA2A P08913 2/20 0.43
TACR2 P21452 2/20 0.43
SLC6A4 P31645 2/20 0.43
SLC6A3 Q01959 2/20 0.43
ALDH1A1 P00352 2/20 0.43
LMNA P02545 2/20 0.43

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
SCHEMBL6286592 1.00 NR5A1 (0.55) NR5A1LTA4HADORA3SLC6A2CHRM1
SCHEMBL6284126 1.00 NR5A1 (0.55) NR5A1LTA4HADORA3SLC6A2CHRM1
SCHEMBL6279210 1.00 NR5A1 (0.55) NR5A1LTA4HADORA3SLC6A2CHRM1
SCHEMBL6282175 1.00 NR5A1 (0.55) NR5A1LTA4HADORA3SLC6A2CHRM1
SCHEMBL6284352 1.00 NR5A1 (0.55) NR5A1LTA4HADORA3SLC6A2CHRM1
SCHEMBL6283193 1.00 NR5A1 (0.55) NR5A1LTA4HADORA3SLC6A2CHRM1
SCHEMBL6284549 0.92 NR5A1 (0.50) NR5A1LTA4HADORA3SLC6A2CHRM1
SCHEMBL6278813 0.92 NR5A1 (0.50) NR5A1LTA4HADORA3SLC6A2CHRM1
SCHEMBL6279760 0.92 NR5A1 (0.50) NR5A1LTA4HADORA3SLC6A2CHRM1
SCHEMBL6279339 0.92 NR5A1 (0.50) NR5A1LTA4HADORA3SLC6A2CHRM1

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-6911468-B2 Tyrosine phosphatase inhibitors TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2005-06-28 US disclosed
US-20030144338-A1 Tyrosine phosphatase inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2003-07-31 US disclosed
EP-1284260-A1 TYROSINE PHOSPHATASE INHIBITORS Takeda Chemical Industries, Ltd. (JP) 2003-02-19 EP 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-20030144338-A1 Tyrosine phosphatase inhibitors PTPRC, PTPN1, PTPRM NR5A1 160/4885LTA4H 4503/4885ADORA3 4774/4885

“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.