SCHEMBL3053992

SCHEMBL3053992

NC(=O)CC(Cc1ccc(Cl)cc1)NCC(=O)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.47
KMT2A Q03164 4/20 0.43
MEN1 O00255 3/20 0.43
AGTR1 P30556 1/20 0.43
MAPT P10636 2/20 0.42
ALDH1A1 P00352 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
DPP7 Q9UHL4 2/20 0.41
MME P08473 1/20 0.41
SIGMAR1 Q99720 1/20 0.39
PSMB8 P28062 1/20 0.39
PSMB5 P28074 1/20 0.39
SLC6A4 P31645 1/20 0.38
CTRB1 P17538 1/20 0.38
POLB P06746 1/20 0.38
HPGD P15428 1/20 0.38
PPARG P37231 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
SCHEMBL3040846 1.00 DPP4 (0.47) DPP4KMT2AMEN1AGTR1MAPT
SCHEMBL3045267 0.91 DPP4 (0.47) DPP4KMT2AMEN1MAPTMME
SCHEMBL3059934 0.91 DPP4 (0.47) DPP4KMT2AMEN1MAPTMME
SCHEMBL3058398 0.91 DPP4 (0.47) DPP4KMT2AMEN1MAPTMME
SCHEMBL3050470 0.87 DPP4 (0.47) DPP4KMT2AMEN1AGTR1MAPT
SCHEMBL3053952 0.87 DPP4 (0.47) DPP4KMT2AMEN1AGTR1MAPT
SCHEMBL8820357 0.75 MAPK1 (0.51) DPP4KMT2AMEN1MAPTNPC1
SCHEMBL3706360 0.74 DPP4 (0.47) DPP4KMT2AMEN1MAPTMME
SCHEMBL18562109 0.72 TSHR (0.47) DPP4KMT2AMEN1AGTR1MAPT
SCHEMBL3790429 0.72 SIGMAR1 (0.50) NPC1RAB9ASIGMAR1

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 4 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
WO-2010086366-A1 4-ARYL-BUTANE-1,3-DIAMIDES NOVARTIS AG (CH) 2010-08-05 WO 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 DPP4 139/4885KMT2A 3047/4885MEN1 507/4885

“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.