SCHEMBL4775798

SCHEMBL4775798

NC(Cc1ccc(Cl)cc1)C(=O)N1CCN(c2ccc(F)cc2)CC1

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.64
KMT2A Q03164 1/20 0.64
AKT1 P31749 13/20 0.62
MAPT P10636 2/20 0.58
TP53 P04637 1/20 0.58
HSP90AA1 P07900 1/20 0.57
AKT2 P31751 2/20 0.55
AKT3 Q9Y243 2/20 0.55
AKT1S1 Q96B36 1/20 0.55
POLB P06746 1/20 0.54

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
SCHEMBL4776488 0.88 MAPT (0.58) MEN1KMT2AAKT1MAPTTP53
SCHEMBL4772342 0.88 POLB (0.62) AKT1MAPTTP53AKT2AKT3
SCHEMBL4773309 0.87 AKT1 (0.57) MEN1KMT2AAKT1MAPTTP53
Hydrochloric Acid SCHEMBL6980746 0.86 POLB (0.61) AKT1MAPTTP53AKT2AKT3
SCHEMBL4795185 0.86 DPP4 (0.60) MEN1KMT2AAKT1MAPTTP53
SCHEMBL4770054 0.85 AKT1 (0.57) AKT1TP53AKT2AKT3AKT1S1
SCHEMBL4778450 0.84 HDAC8 (0.58) MEN1KMT2AAKT1HSP90AA1AKT2
SCHEMBL4778157 0.82 AKT1 (0.56) MEN1KMT2AAKT1AKT1S1
SCHEMBL4773516 0.81 TP53 (0.59) MEN1KMT2AAKT1MAPTTP53
SCHEMBL4776886 0.80 AKT1 (0.56) AKT1MAPTTP53AKT2AKT3

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
EP-1996550-A2 CARBOXYAMINE COMPOUNDS AND THEIR USE IN THE TREATMENT OF HDAC DEPENDENT DISEASES Novartis AG (CH) 2008-12-03 EP claimed
US-20080255149-A1 Carboxyamine Compounds and Methods of Use Thereof NOVARTIS AG 2008-10-16 US claimed
WO-2007038459-A2 CARBOXYAMINE COMPOUNDS AND THEIR USE IN THE TREATMENT OF HDAC DEPENDENT DISEASES NOVARTIS AG (CH) 2007-04-05 WO claimed
US-20080255149-A1 Carboxyamine Compounds and Methods of Use Thereof NOVARTIS AG 2008-10-16 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-20080255149-A1 Carboxyamine Compounds and Methods of Use Thereof HNMT, HDAC5, HDAC4 MEN1 1807/4885KMT2A 41/4885AKT1 3114/4885

“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.