SCHEMBL3048416

SCHEMBL3048416

CN(C(=O)c1cccc(OC(F)(F)F)c1)[C@H](CCN)Cc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 1/20 0.51
HCRTR2 O43614 1/20 0.51
TRPM8 Q7Z2W7 1/20 0.49
HDAC8 Q9BY41 1/20 0.44
GPR139 Q6DWJ6 1/20 0.42
MAPK14 Q16539 1/20 0.41
MRGPRX4 Q96LA9 2/20 0.40
KMT2A Q03164 2/20 0.40
KAT6A Q92794 1/20 0.40
PTGER4 P35408 1/20 0.40
PTGER2 P43116 1/20 0.40
HTR2C P28335 1/20 0.39
CETP P11597 3/20 0.39
MEN1 O00255 1/20 0.38
GPR132 Q9UNW8 1/20 0.38

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
SCHEMBL3058136 1.00 HCRTR1 (0.51) HCRTR1HCRTR2TRPM8HDAC8GPR139
SCHEMBL3048414 0.88 TRPM8 (0.52) HCRTR1HCRTR2TRPM8HDAC8GPR139
SCHEMBL3058133 0.88 TRPM8 (0.52) HCRTR1HCRTR2TRPM8HDAC8GPR139
SCHEMBL3049769 0.87 HCRTR1 (0.52) HCRTR1HCRTR2GPR139MRGPRX4KMT2A
SCHEMBL2013190 0.87 HCRTR1 (0.52) HCRTR1HCRTR2GPR139MRGPRX4KMT2A
SCHEMBL3046978 0.85 HCRTR1 (0.64) HCRTR1HCRTR2MRGPRX4KMT2AKAT6A
SCHEMBL3058134 0.85 HCRTR1 (0.64) HCRTR1HCRTR2MRGPRX4KMT2AKAT6A
SCHEMBL3058235 0.84 TRPM8 (0.47) HCRTR1HCRTR2TRPM8HDAC8HTR2C
SCHEMBL3060252 0.84 TRPM8 (0.47) HCRTR1HCRTR2TRPM8HDAC8HTR2C
SCHEMBL3053244 0.83 HCRTR1 (0.55) HCRTR1HCRTR2KMT2AKAT6AMEN1

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 HCRTR1 3230/4885HCRTR2 3029/4885TRPM8 1326/4885

“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.