SCHEMBL6285926

SCHEMBL6285926

CCCCCCCCCCCOc1ccc(CCn2c(C)ccc2-c2ccc(O[C@H](Cc3ccccc3)C(=O)O)cc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.68
PGR P06401 1/20 0.56
ADORA3 P0DMS8 1/20 0.56
CHRM1 P11229 1/20 0.56
TBXA2R P21731 1/20 0.56
PTGS1 P23219 1/20 0.56
SLC6A2 P23975 1/20 0.56
PDE4A P27815 1/20 0.56
ADRA1A P35348 1/20 0.56
DRD3 P35462 1/20 0.56
PPARA Q07869 15/20 0.53
PPARG P37231 15/20 0.51

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
SCHEMBL6286145 1.00 PTPN1 (0.68) PTPN1PGRADORA3CHRM1TBXA2R
SCHEMBL6279623 1.00 PTPN1 (0.68) PTPN1PGRADORA3CHRM1TBXA2R
SCHEMBL6285738 1.00 PTPN1 (0.68) PTPN1PGRADORA3CHRM1TBXA2R
SCHEMBL6287133 1.00 PTPN1 (0.68) PTPN1PGRADORA3CHRM1TBXA2R
SCHEMBL6282793 1.00 PTPN1 (0.68) PTPN1PGRADORA3CHRM1TBXA2R
SCHEMBL6286007 1.00 PTPN1 (0.68) PTPN1PGRADORA3CHRM1TBXA2R
SCHEMBL6286516 0.95 PTPN1 (0.65) PTPN1PGRADORA3CHRM1TBXA2R
SCHEMBL6283196 0.94 PTPN1 (0.72) PTPN1PGRADORA3CHRM1TBXA2R
SCHEMBL6279622 0.94 PTPN1 (0.72) PTPN1PGRADORA3CHRM1TBXA2R
SCHEMBL6279521 0.94 PTPN1 (0.72) PTPN1PGRADORA3CHRM1TBXA2R

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 PTPN1 2/4885PGR 2273/4885ADORA3 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.