SCHEMBL6479587

SCHEMBL6479587

O=C(Nc1cccc(-c2ccc(Cl)cc2Cl)c1)Nc1ccccc1CCO

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 3/20 0.56
GRIK1 P39086 1/20 0.50
CNR1 P21554 8/20 0.48
KDR P35968 1/20 0.47
PTGER3 P43115 1/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
ALDH1A1 P00352 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
KDM4E B2RXH2 1/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
SUCNR1 Q9BXA5 1/20 0.45
MAPT P10636 2/20 0.45

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
SCHEMBL6480232 0.91 TRPV1 (0.62) TRPV1GRIK1CNR1PTGER3MEN1
SCHEMBL6478899 0.90 TRPV1 (0.59) TRPV1GRIK1CNR1KDRPTGER3
SCHEMBL6490705 0.88 TRPV1 (0.58) TRPV1GRIK1CNR1PTGER3MEN1
SCHEMBL6488133 0.86 CNR1 (0.64) TRPV1GRIK1CNR1MEN1KMT2A
SCHEMBL23831812 0.85 TRPV1 (0.63) TRPV1GRIK1PTGER3MEN1KMT2A
SCHEMBL30792273 0.85 TRPV1 (0.63) TRPV1GRIK1PTGER3MEN1KMT2A
SCHEMBL6489149 0.83 TRPV1 (0.59) TRPV1GRIK1CNR1KDRPTGER3
SCHEMBL6490134 0.82 MGLL (0.65) TRPV1GRIK1CNR1MEN1KMT2A
SCHEMBL6478147 0.81 TRPV1 (0.65) TRPV1CNR1MEN1KMT2AALDH1A1
SCHEMBL6490717 0.80 MAPT (0.56) TRPV1CNR1KDRPTGER3MEN1

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
US-20050154230-A1 Urea derivatives BAYER HEALTHCARE AG (DE) 2005-07-14 US claimed
US-20050154230-A1 Urea derivatives BAYER HEALTHCARE AG (DE) 2005-07-14 US disclosed
EP-1461311-A2 UREA DERIVATIVES AS VR1-ANTAGONISTS Bayer HealthCare AG (DE) 2004-09-29 EP disclosed
WO-2003055848-A2 UREA DERIVATIVES AS VR1- ANTAGONISTS BAYER HEALTHCARE AG (DE) 2003-07-10 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-20050154230-A1 Urea derivatives SLC14A1, UBA1, VAT1 TRPV1 214/4885GRIK1 84/4885CNR1 323/4885

“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.