SCHEMBL1410260

SCHEMBL1410260

O=C(O)CCC1CCN(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)S1(=O)=O

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ FFAR4 Q5NUL3 7/20 0.44
▸ LMNA P02545 1/20 0.39
▸ NOTUM Q6P988 2/20 0.36
▸ CXCR3 P49682 2/20 0.35
▸ PTPN11 Q06124 1/20 0.35
▸ DPP4 P27487 1/20 0.34
▸ RXRA P19793 2/20 0.33
▸ RXRB P28702 2/20 0.33
▸ RXRG P48443 2/20 0.33
▸ TACR1 P25103 2/20 0.33
▸ ADRB1 P08588 1/20 0.33

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
SCHEMBL1410258 0.87 FFAR4 (0.44) FFAR4LMNANOTUMCXCR3PTPN11
SCHEMBL1410145 0.85 ALDH1A1 (0.37) FFAR4LMNADPP4TACR1
SCHEMBL12209937 0.80 NOTUM (0.36) FFAR4LMNANOTUM
SCHEMBL1410217 0.74 FFAR4 (0.37) FFAR4NOTUMDPP4TACR1
SCHEMBL14300692 0.73 FFAR4 (0.38) FFAR4LMNANOTUMADRB1
SCHEMBL14300690 0.73 FFAR4 (0.38) FFAR4LMNANOTUMADRB1
SCHEMBL1410142 0.73 ALDH1A1 (0.37) FFAR4LMNADPP4
SCHEMBL1410097 0.71 ADRB1 (0.37) FFAR4NOTUMDPP4ADRB1
SCHEMBL1409875 0.71 FFAR4 (0.54) FFAR4LMNANOTUMPTPN11DPP4
SCHEMBL1410213 0.68 ALDH1A1 (0.36) FFAR4LMNATACR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2295406-B1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL (JP) 2014-04-23 — — EP disclosed
US-8338622-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-12-25 — — US disclosed
US-8338622-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-12-25 — — US disclosed
US-8338622-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-12-25 — — US disclosed
US-20110251187-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-10-13 — — US disclosed
US-20110251187-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-10-13 — — US disclosed
US-20110251187-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-10-13 — — US disclosed
EP-2295406-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2011-03-16 — — EP disclosed
WO-2009145286-A1 HETEROCYCLIC COMPOUND 武田薬品工業株式会社 (JP) 2009-12-03 — — 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-20110251187-A1 HETEROCYCLIC COMPOUND NES, BMI1, DOT1L FFAR4 4589/4885LMNA 2590/4885NOTUM 874/4885

“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.

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