SCHEMBL4620723

SCHEMBL4620723

FC(F)(F)c1ccc(-c2cc(Cl)ncn2)c(NCC2CC2)c1

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LIPC P11150 1/20 0.46
LIPG Q9Y5X9 1/20 0.46
CRHR1 P34998 17/20 0.41
GPR39 O43194 1/20 0.39
IDH1 O75874 1/20 0.37

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
SCHEMBL4621483 0.95 LIPC (0.42) LIPCLIPGCRHR1GPR39
SCHEMBL4621959 0.94 LIPC (0.41) LIPCLIPGCRHR1GPR39
SCHEMBL5916890 0.78 CYP1A2 (0.41)
SCHEMBL4620138 0.75 LMNA (0.40)
SCHEMBL5916942 0.74 TRPV1 (0.60) LIPCLIPGCRHR1GPR39
SCHEMBL5917026 0.74 TRPV1 (0.49) LIPCLIPGCRHR1GPR39
SCHEMBL4618878 0.74 TRPV1 (0.51) LIPCLIPGCRHR1GPR39
SCHEMBL5917081 0.74 TRPV1 (0.60) LIPCLIPGCRHR1GPR39
SCHEMBL5916919 0.74 TRPV1 (0.60) LIPCLIPGCRHR1GPR39
SCHEMBL16647952 0.73 MPL (0.49)

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 LIPC 3707/4885LIPG 593/4885CRHR1 1522/4885

“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.