SCHEMBL6479657

SCHEMBL6479657

COc1cc(CNC(=O)Nc2ccc(C)c(Cl)c2)ccc1O

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.60
MEN1 O00255 1/20 0.56
HTT P42858 1/20 0.56
KMT2A Q03164 1/20 0.56
DDB1 Q16531 3/20 0.55
CRBN Q96SW2 3/20 0.55
ERCC1 P07992 1/20 0.53
ERCC4 Q92889 1/20 0.53
TRPV1 Q8NER1 1/20 0.52
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
MAPT P10636 1/20 0.51
PTPN7 P35236 1/20 0.51
DUSP3 P51452 1/20 0.51
GSPT1 P15170 1/20 0.51
ALDH1A1 P00352 2/20 0.50

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
SCHEMBL6479194 0.91 MEN1 (0.55) MEN1KMT2AERCC1ERCC4TRPV1
SCHEMBL6480854 0.86 ERCC1 (0.72) MEN1KMT2AERCC1ERCC4TRPV1
SCHEMBL6480358 0.83 RAB9A (0.71) MEN1KMT2AERCC1ERCC4NPC1
SCHEMBL6481200 0.83 CA1 (0.63) MEN1HTTKMT2AERCC1ERCC4
SCHEMBL6479804 0.81 MEN1 (0.58) MEN1KMT2AERCC1ERCC4TRPV1
SCHEMBL6479417 0.78 NPC1 (0.55) HTTERCC1ERCC4NPC1RAB9A
SCHEMBL6480802 0.77 NPC1 (0.60) MEN1HTTKMT2AERCC1ERCC4
SCHEMBL297477 0.76 ALDH1A1 (0.64) MEN1KMT2ATRPV1ALDH1A1
SCHEMBL5641999 0.75 ROCK2 (0.66) MEN1KMT2ANPC1RAB9A
SCHEMBL24495273 0.75 EPHX2 (0.74) EPHX2DDB1CRBNNPC1RAB9A

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 6 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
EP-1461311-A2 UREA DERIVATIVES AS VR1-ANTAGONISTS Bayer HealthCare AG (DE) 2004-09-29 EP claimed
WO-2003055848-A2 UREA DERIVATIVES AS VR1- ANTAGONISTS BAYER HEALTHCARE AG (DE) 2003-07-10 WO 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 EPHX2 4573/4885MEN1 4397/4885HTT 1227/4885

“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.