SCHEMBL6481200

SCHEMBL6481200

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

nearest known ligand 0.63

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.63
CA2 P00918 3/20 0.63
CA7 P43166 3/20 0.63
CA9 Q16790 3/20 0.63
MAPT P10636 4/20 0.59
MEN1 O00255 1/20 0.59
HTT P42858 1/20 0.59
KMT2A Q03164 1/20 0.59
LMNA P02545 4/20 0.57
SMN1; SMN2 Q16637 1/20 0.56
KDR P35968 2/20 0.55
GAA P10253 1/20 0.53
SLC6A3 Q01959 1/20 0.52
TRPV1 Q8NER1 1/20 0.51
CASR P41180 1/20 0.49
ERCC1 P07992 1/20 0.49
ERCC4 Q92889 1/20 0.49
RAF1 P04049 2/20 0.49
BRAF P15056 1/20 0.48

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 0.87 MEN1 (0.55) MAPTMEN1KMT2ALMNASMN1; SMN2
SCHEMBL6479657 0.83 EPHX2 (0.60) MAPTMEN1HTTKMT2ASMN1; SMN2
SCHEMBL6480854 0.82 ERCC1 (0.72) MEN1KMT2ATRPV1ERCC1ERCC4
SCHEMBL6487476 0.82 LMNA (0.57) MAPTMEN1KMT2ALMNASMN1; SMN2
SCHEMBL6480358 0.79 RAB9A (0.71) MAPTMEN1KMT2ALMNASMN1; SMN2
SCHEMBL1792474 0.78 CA1 (0.59) CA1CA2CA7CA9MAPT
SCHEMBL6479804 0.78 MEN1 (0.58) MAPTMEN1KMT2ALMNASMN1; SMN2
SCHEMBL15682785 0.78 MAPT (0.55) CA1CA2CA7CA9MAPT
SCHEMBL1789524 0.77 CA1 (0.58) CA1CA2CA7CA9KDR
SCHEMBL19668140 0.77 KDR (0.74) CA1CA2CA7CA9MAPT

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 CA1 2084/4885CA2 2772/4885CA7 4260/4885

“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.