SCHEMBL1410258

SCHEMBL1410258

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 12)

geneUniProtsupporting neighboursconfidence
▸ FFAR4 Q5NUL3 7/20 0.44
▸ LMNA P02545 1/20 0.39
▸ NOTUM Q6P988 2/20 0.36
▸ PTPN11 Q06124 1/20 0.35
▸ DPP4 P27487 1/20 0.34
▸ TACR1 P25103 2/20 0.33
▸ RXRA P19793 2/20 0.33
▸ RXRB P28702 2/20 0.33
▸ RXRG P48443 2/20 0.33
▸ ADRB1 P08588 1/20 0.33
▸ CHRM4 P08173 1/20 0.33
▸ CXCR3 P49682 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
SCHEMBL1410260 0.87 FFAR4 (0.44) FFAR4LMNANOTUMPTPN11DPP4
SCHEMBL1410142 0.85 ALDH1A1 (0.37) FFAR4LMNADPP4
SCHEMBL14300691 0.73 FFAR4 (0.38) FFAR4LMNANOTUMADRB1
SCHEMBL14300689 0.73 FFAR4 (0.38) FFAR4LMNANOTUMADRB1
SCHEMBL1410145 0.73 ALDH1A1 (0.37) FFAR4LMNADPP4TACR1
SCHEMBL1410214 0.72 FFAR4 (0.37) FFAR4NOTUMDPP4TACR1
SCHEMBL1410216 0.72 FFAR4 (0.37) FFAR4NOTUMDPP4TACR1
SCHEMBL1409875 0.71 FFAR4 (0.54) FFAR4LMNANOTUMPTPN11DPP4
SCHEMBL12209937 0.66 NOTUM (0.36) FFAR4LMNANOTUM
SCHEMBL14300692 0.66 FFAR4 (0.38) FFAR4LMNANOTUMADRB1

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
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-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

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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