SCHEMBL1410366

SCHEMBL1410366

O=C(O)CCC1CCC(c2cc(F)cc(C(F)(F)F)c2)O1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 3/20 0.47
▸ FFAR4 Q5NUL3 6/20 0.40
▸ RXRA P19793 1/20 0.38
▸ RXRB P28702 1/20 0.38
▸ RXRG P48443 1/20 0.38
▸ RORC P51449 6/20 0.37
▸ RIPK1 Q13546 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ GPR17 Q13304 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ TACR1 P25103 1/20 0.32
▸ SLC6A2 P23975 1/20 0.32
▸ SLC6A4 P31645 1/20 0.32
▸ SLC6A3 Q01959 1/20 0.32

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
SCHEMBL1410337 0.92 LMNA (0.41) FFAR1FFAR4RXRARXRBRXRG
SCHEMBL1410139 0.92 LMNA (0.41) FFAR1FFAR4RXRARXRBRXRG
SCHEMBL1410779 0.92 LMNA (0.41) FFAR1FFAR4RXRARXRBRXRG
SCHEMBL1410365 0.85 FFAR1 (0.38) FFAR1FFAR4RORCRIPK1SLC6A2
Tromethamine SCHEMBL1410570 0.84 LMNA (0.36) FFAR1FFAR4RXRARXRBRXRG
SCHEMBL1410504 0.83 RXRA (0.42) FFAR1FFAR4RXRARXRBRXRG
SCHEMBL1409539 0.82 FFAR1 (0.47) FFAR1FFAR4RORCSLC6A2SLC6A4
SCHEMBL1410689 0.80 FFAR4 (0.44) FFAR1FFAR4RXRARXRBRXRG
SCHEMBL1410134 0.77 ALDH1A1 (0.38) RORCSLC6A2SLC6A4SLC6A3
SCHEMBL1410421 0.75 PTGIR (0.38) FFAR1FFAR4RXRARXRBRXRG

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 8 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

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 FFAR1 4753/4885FFAR4 4589/4885RXRA 1004/4885

“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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