SCHEMBL6583048

SCHEMBL6583048

O=C(Nc1cccc2ccc(O)cc12)C(F)(F)F

nearest known ligand 0.65

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 19/20 0.65
KDM4E B2RXH2 1/20 0.62
MEN1 O00255 1/20 0.62
MAPT P10636 1/20 0.62
RAB9A P51151 1/20 0.62
KMT2A Q03164 1/20 0.62

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
SCHEMBL5551553 0.82 HDAC1 (0.70) KDM4EMEN1MAPTRAB9AKMT2A
Trifluoroacetic Acid SCHEMBL4852422 0.82 TRPV1 (0.58) TRPV1KDM4EMEN1MAPTRAB9A
SCHEMBL2676769 0.81 TRPV1 (0.70) TRPV1KDM4EMEN1MAPTRAB9A
SCHEMBL12441715 0.80 TRPV1 (0.54) TRPV1KDM4EMEN1MAPTRAB9A
SCHEMBL30125341 0.80 TRPV1 (0.64) TRPV1KDM4EMEN1MAPTRAB9A
SCHEMBL1413170 0.80 TRPV1 (0.64) TRPV1KDM4EMEN1MAPTRAB9A
SCHEMBL1269411 0.80 KDM4E (0.69) TRPV1KDM4EMEN1MAPTRAB9A
SCHEMBL6584655 0.77 TRPV1 (1.00) TRPV1KDM4EMEN1MAPTRAB9A
SCHEMBL30125017 0.77 TRPV1 (0.70) TRPV1KDM4EMEN1MAPTRAB9A
SCHEMBL1413214 0.77 TRPV1 (0.70) TRPV1KDM4EMEN1MAPTRAB9A

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-20040259875-A1 Amine derivatives BAYER HEALTHCARE AG (DE) 2004-12-23 US disclosed
EP-1414788-A1 NAPHTHYLUREA AND NAPHTHYLACETAMIDE DERIVATIVES AS VANILLOID RECEPTOR 1 (VR1) ANTAGONISTS Bayer HealthCare AG (DE) 2004-05-06 EP disclosed
WO-2003014064-A1 NAPHTHYLUREA AND NAPHTHYLACETAMIDE DERIVATIVES AS VANILLOID RECEPTOR 1 (VR1) ANTAGONISTS BAYER HEALTHCARE AG (DE) 2003-02-20 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-20040259875-A1 Amine derivatives AVPR1A, GRIN1, OPRL1 TRPV1 14/4885KDM4E 3941/4885MEN1 3369/4885

“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.