SCHEMBL6279550

SCHEMBL6279550

Cc1ccc(CCc2ccccc2-c2ccccc2)n1CCc1ccc(O)cc1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GFER P55789 1/20 0.41
FFAR1 O14842 8/20 0.38
FFAR4 Q5NUL3 8/20 0.38
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CASR P41180 2/20 0.36
PDCD1 Q15116 1/20 0.35
CD274 Q9NZQ7 1/20 0.35
PTGER1 P34995 1/20 0.35
PTGER4 P35408 1/20 0.35
PTGER3 P43115 1/20 0.35
PTGER2 P43116 1/20 0.35
NR1H3 Q13133 1/20 0.35
MAPT P10636 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
EGLN1 Q9GZT9 1/20 0.34

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
SCHEMBL6284213 0.86 FFAR1 (0.39) FFAR1FFAR4
SCHEMBL6285799 0.81 GFER (0.46) GFERFFAR1CASRMAPT
SCHEMBL6285918 0.80 HDAC1 (0.39) GFERFFAR1FFAR4CASRMAPT
SCHEMBL6279305 0.76 LMNA (0.54) GFERFFAR1FFAR4MAPT
SCHEMBL10456914 0.73 ESR2 (0.54) FFAR1FFAR4CA2PTGER1PTGER4
Phenol SCHEMBL28213161 0.72 PPARA (0.50) FFAR1FFAR4PDCD1CD274PTGER1
SCHEMBL28638330 0.70 ABL1 (0.54) PTGER1PTGER4PTGER3PTGER2
SCHEMBL6279605 0.68 PTGER1 (0.36) GFERCASRPTGER1MAPT
SCHEMBL27768912 0.67 KEAP1 (0.60) FFAR1FFAR4PDCD1CD274
SCHEMBL31489838 0.67 DPP4 (0.56) FFAR1FFAR4CA1CA2PDCD1

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 GFER 2720/4885FFAR1 2437/4885FFAR4 3310/4885

“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.