SCHEMBL2259494

SCHEMBL2259494

O=C(COc1cc(C(F)(F)F)nn1-c1ccccc1Cl)NCc1cc(F)ccc1F

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 13/20 0.53
▸ P2RX7 Q99572 4/20 0.49
▸ CNR1 P21554 1/20 0.44

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
SCHEMBL2257230 0.93 TRPV1 (0.52) TRPV1P2RX7
SCHEMBL2258107 0.92 P2RX7 (0.58) TRPV1P2RX7
SCHEMBL2256831 0.92 TRPV1 (0.52) TRPV1P2RX7CNR1
SCHEMBL2257432 0.89 TRPV1 (0.48) TRPV1P2RX7CNR1
SCHEMBL2261075 0.88 TRPV1 (0.46) TRPV1P2RX7
SCHEMBL2255449 0.88 NPSR1 (0.51) TRPV1P2RX7
SCHEMBL2260645 0.87 TRPV1 (0.49) TRPV1P2RX7CNR1
SCHEMBL2257576 0.87 TRPV1 (0.46) TRPV1P2RX7
SCHEMBL2258902 0.87 P2RX7 (0.44) TRPV1P2RX7
SCHEMBL2257715 0.86 TRPV1 (0.51) TRPV1P2RX7CNR1

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-2121621-B1 LXR AND FXR MODULATORS EXELIXIS PATENT CO LLC (US) 2014-05-07 — — EP disclosed
EP-2121621-B1 LXR AND FXR MODULATORS EXELIXIS PATENT CO LLC (US) 2014-05-07 — — EP disclosed
US-7998995-B2 LXR and FXR modulators EXELIXIS PATENT COMPANY LLC (US) 2011-08-16 — — US disclosed
US-7998995-B2 LXR and FXR modulators EXELIXIS PATENT COMPANY LLC (US) 2011-08-16 — — US disclosed
US-7998995-B2 LXR and FXR modulators EXELIXIS PATENT COMPANY LLC (US) 2011-08-16 — — US disclosed
US-20100069367-A1 LXR and FXR Modulators EXELIXIS, INC. (US) 2010-03-18 — — US disclosed
US-20100069367-A1 LXR and FXR Modulators EXELIXIS, INC. (US) 2010-03-18 — — US disclosed
US-20100069367-A1 LXR and FXR Modulators EXELIXIS, INC. (US) 2010-03-18 — — US 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-20100069367-A1 LXR and FXR Modulators NR1H3, NR1H2, NR1H4 TRPV1 1100/4885P2RX7 797/4885CNR1 119/4885

“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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