SCHEMBL6490134

SCHEMBL6490134

O=C(Nc1cccc(-c2ccccc2)c1)Nc1ccccc1CCO

nearest known ligand 0.65

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 2/20 0.65
TRPV1 Q8NER1 2/20 0.57
CNR1 P21554 5/20 0.55
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
MAPT P10636 1/20 0.53
GRIK1 P39086 1/20 0.53
CASR P41180 1/20 0.49
DDX3X O00571 1/20 0.48
HDAC1 Q13547 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46

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
SCHEMBL6488133 0.91 CNR1 (0.64) MGLLTRPV1CNR1MEN1KMT2A
SCHEMBL6489054 0.91 CNR1 (0.57) MGLLTRPV1CNR1MEN1KMT2A
SCHEMBL6478776 0.90 MEN1 (0.65) MGLLTRPV1CNR1MEN1KMT2A
SCHEMBL6490705 0.90 TRPV1 (0.58) MGLLTRPV1CNR1MEN1KMT2A
SCHEMBL6480620 0.89 MGLL (0.51) MGLLTRPV1CNR1MEN1KMT2A
SCHEMBL6480400 0.88 MGLL (0.50) MGLLTRPV1CNR1MEN1KMT2A
SCHEMBL6490081 0.88 TRPV1 (0.60) MGLLTRPV1CNR1MEN1KMT2A
SCHEMBL6487078 0.88 TRPV1 (0.54) MGLLTRPV1CNR1MEN1KMT2A
SCHEMBL6479242 0.87 DDX3X (0.51) MGLLTRPV1CNR1MEN1KMT2A
SCHEMBL6479088 0.86 CNR1 (0.60) MGLLTRPV1CNR1MEN1KMT2A

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-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 MGLL 4556/4885TRPV1 214/4885CNR1 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.