SCHEMBL3060314

SCHEMBL3060314

CN(C(=O)c1ccc(C(F)(F)F)cc1)C(CCN)Cc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
MLYCD O95822 3/20 0.44
PPARG P37231 2/20 0.43
PPARA Q07869 2/20 0.43
TMEM97 Q5BJF2 1/20 0.43
SIGMAR1 Q99720 1/20 0.43
SLC6A9 P48067 1/20 0.43
MTOR P42345 1/20 0.42
KIF11 P52732 1/20 0.42
GRIN2B Q13224 1/20 0.40
FPR2 P25090 1/20 0.40
CTSL P07711 1/20 0.40
TRPM8 Q7Z2W7 1/20 0.39
TACR1 P25103 1/20 0.39
SRD5A2 P31213 1/20 0.39
HTR1A P08908 1/20 0.39
TP53 P04637 1/20 0.39
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39

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
SCHEMBL3048428 1.00 MEN1 (0.46) MEN1KMT2AMLYCDPPARGPPARA
SCHEMBL3058235 0.87 TRPM8 (0.47) PPARGPPARAKIF11TRPM8TACR1
SCHEMBL3060252 0.87 TRPM8 (0.47) PPARGPPARAKIF11TRPM8TACR1
SCHEMBL3058403 0.87 HTR1A (0.47) MEN1KMT2AHTR1APOLBMAPT
SCHEMBL3045271 0.87 HTR1A (0.47) MEN1KMT2AHTR1APOLBMAPT
SCHEMBL3059938 0.87 HTR1A (0.47) MEN1KMT2AHTR1APOLBMAPT
SCHEMBL3048426 0.86 MEN1 (0.46) MEN1KMT2AMLYCDPPARGPPARA
SCHEMBL3060312 0.86 MEN1 (0.46) MEN1KMT2AMLYCDPPARGPPARA
SCHEMBL3059763 0.84 KMT2A (0.42) MEN1KMT2ATMEM97SIGMAR1FPR2
SCHEMBL3053145 0.84 KMT2A (0.42) MEN1KMT2ATMEM97SIGMAR1FPR2

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
US-20100222396-A1 4-ARYL-BUTANE-1,3-DIAMIDES NOVARTIS AG (CH) 2010-09-02 US claimed
US-20100222396-A1 4-ARYL-BUTANE-1,3-DIAMIDES NOVARTIS AG (CH) 2010-09-02 US disclosed
WO-2010086366-A1 4-ARYL-BUTANE-1,3-DIAMIDES NOVARTIS AG (CH) 2010-08-05 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-20100222396-A1 4-ARYL-BUTANE-1,3-DIAMIDES CYP11B2, CYP11B1, BBC3 MEN1 507/4885KMT2A 3047/4885MLYCD 1759/4885

“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.