SCHEMBL4620148

SCHEMBL4620148

O=C(O)N(c1cccc(C(F)(F)F)c1)c1cc(Cl)ncn1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 2/20 0.47
RXRB P28702 2/20 0.47
RXRG P48443 2/20 0.47
KMO O15229 2/20 0.41
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
KCNQ3 O43525 2/20 0.39
KCNQ2 O43526 2/20 0.39
KCNE1 P15382 2/20 0.39
KCNQ1 P51787 2/20 0.39
KCNH2 Q12809 1/20 0.38
KCNQ5 Q9NR82 1/20 0.38
CES2 O00748 1/20 0.37
BRAF P15056 1/20 0.36
KDR P35968 1/20 0.36
MAPK14 Q16539 1/20 0.36
TNNI3K Q59H18 1/20 0.36
EGFR P00533 2/20 0.36
CSF1R P07333 2/20 0.36
PTGIR P43119 1/20 0.36

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
SCHEMBL4620459 0.84 RXRA (0.46) RXRARXRBRXRGKMOMEN1
SCHEMBL7782549 0.79 RXRA (0.54) RXRARXRBRXRGMEN1KMT2A
SCHEMBL2094545 0.76 MEN1 (0.49) MEN1KMT2ACES2PTGIRMAPT
SCHEMBL57464 0.73 POLQ (0.40) KMOMEN1KMT2APTGIRMAPT
SCHEMBL5916807 0.72 EGFR (0.45) BRAFKDRMAPK14TNNI3KEGFR
SCHEMBL1118844 0.71 PTGIR (0.46) MEN1KMT2ACES2PTGIRMAPT
SCHEMBL1013242 0.70 CES2 (0.49) RXRARXRBRXRGMEN1KMT2A
SCHEMBL59042 0.70 PPARG (0.40) KMOMEN1KMT2ALIPE
SCHEMBL31749702 0.70 RXRA (0.37) RXRARXRBRXRGMEN1KMT2A
SCHEMBL2094544 0.69 MEN1 (0.47) MEN1KMT2ACES2PTGIRMAPT

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
EP-1883632-A1 VANILLOID RECEPTOR LIGANDS AND THEIR USE IN TREATMENTS Amgen Inc. (US) 2008-02-06 EP disclosed
WO-2006116563-A1 VANILLOID RECEPTOR LIGANDS AND THEIR USE IN TREATMENTS AMGEN INC. (US) 2006-11-02 WO disclosed
US-20060241296-A1 Acute, inflammatory or neuropathic pain and inflammatory diseases such as asthma, rheumatoid arthritis, inflammatory bowel disorders, urinary incontinence, and psoriasis; e.g. 5-chloro-8-((6-(4-(trifluoromethyl)phenyl)pyrimidin-4-yl)amino)-1,2,3,4-tetrahydronaphthalen-2-ol AMGEN INC. 2006-10-26 US 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-20060241296-A1 Acute, inflammatory or neuropathic pain and inflammatory diseases such as asthma, rheumatoid arthritis, inflammatory bowel disorders, urinary incontinence, and psoriasis; e.g. 5-chloro-8-((6-(4-(trifluoromethyl)phenyl)pyrimidin-4-yl)amino)-1,2,3,4-tetrahydronaphthalen-2-ol TRPV1, HRH2, TRPA1 RXRA 1450/4885RXRB 1760/4885RXRG 374/4885

“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.