SCHEMBL3046288

SCHEMBL3046288

CCN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@H](CC(N)=O)Cc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 13/20 0.47
TRPM8 Q7Z2W7 1/20 0.44
CTSK P43235 1/20 0.38
KCNH2 Q12809 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
GPBAR1 Q8TDU6 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
PPARG P37231 1/20 0.37
PPARA Q07869 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
SCHEMBL3054237 1.00 TACR1 (0.47) TACR1TRPM8CTSKKCNH2HDAC8
SCHEMBL3057806 0.91 TACR1 (0.46) TACR1TRPM8CTSKKCNH2GPBAR1
SCHEMBL3060715 0.91 TACR1 (0.46) TACR1TRPM8CTSKKCNH2GPBAR1
SCHEMBL3061060 0.86 TACR1 (0.52) TACR1TRPM8GPBAR1
SCHEMBL3057776 0.86 TACR1 (0.52) TACR1TRPM8GPBAR1
SCHEMBL3051048 0.86 TACR1 (0.52) TACR1TRPM8GPBAR1
SCHEMBL3058232 0.78 TRPM8 (0.49) TACR1TRPM8KCNH2HDAC8PPARG
SCHEMBL3060247 0.78 TRPM8 (0.49) TACR1TRPM8KCNH2HDAC8PPARG
SCHEMBL3048426 0.76 MEN1 (0.46) TACR1TRPM8PPARGPPARA
SCHEMBL3060312 0.76 MEN1 (0.46) TACR1TRPM8PPARGPPARA

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100222396-A1 4-ARYL-BUTANE-1,3-DIAMIDES NOVARTIS AG (CH) 2010-09-02 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-20100222396-A1 4-ARYL-BUTANE-1,3-DIAMIDES CYP11B2, CYP11B1, BBC3 TACR1 1055/4885TRPM8 1326/4885CTSK 4370/4885

“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.