SCHEMBL4778359

SCHEMBL4778359

Cc1ccc(Cl)cc1N1CCN(C(=O)C(N)Cc2cscn2)CC1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 1/20 0.51
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
USP2 O75604 2/20 0.48
ALDH1A1 P00352 1/20 0.48
MC4R P32245 4/20 0.48
OPRD1 P41143 1/20 0.48
AKT1 P31749 7/20 0.47
MAPT P10636 2/20 0.45
NPC1 O15118 1/20 0.45
AKT2 P31751 1/20 0.44
AKT3 Q9Y243 1/20 0.44
TSHR P16473 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44

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
SCHEMBL4776568 0.82 MC4R (0.50) MEN1KMT2AUSP2ALDH1A1MC4R
SCHEMBL4770245 0.81 MC4R (0.68) MEN1KMT2AUSP2ALDH1A1MC4R
SCHEMBL4909061 0.81 MC4R (0.68) MEN1KMT2AUSP2ALDH1A1MC4R
SCHEMBL4773546 0.81 MC4R (0.61) MEN1KMT2AUSP2ALDH1A1MC4R
SCHEMBL4793769 0.79 MAPT (0.57) MEN1KMT2AUSP2ALDH1A1MC4R
SCHEMBL4794360 0.79 MC4R (0.56) MEN1KMT2AUSP2ALDH1A1MC4R
SCHEMBL4775178 0.79 AKT1 (0.58) MEN1KMT2AUSP2ALDH1A1MC4R
SCHEMBL4775603 0.79 MC4R (0.59) MEN1KMT2AUSP2ALDH1A1MC4R
SCHEMBL4778157 0.78 AKT1 (0.56) MEN1KMT2AUSP2ALDH1A1MC4R
SCHEMBL4793774 0.78 MC4R (0.63) MEN1KMT2AUSP2ALDH1A1MC4R

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 6 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
EP-1996550-A2 CARBOXYAMINE COMPOUNDS AND THEIR USE IN THE TREATMENT OF HDAC DEPENDENT DISEASES Novartis AG (CH) 2008-12-03 EP disclosed
US-20080255149-A1 Carboxyamine Compounds and Methods of Use Thereof NOVARTIS AG 2008-10-16 US disclosed
WO-2007038459-A2 CARBOXYAMINE COMPOUNDS AND THEIR USE IN THE TREATMENT OF HDAC DEPENDENT DISEASES NOVARTIS AG (CH) 2007-04-05 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-20080255149-A1 Carboxyamine Compounds and Methods of Use Thereof HNMT, HDAC5, HDAC4 GRM5 610/4885MEN1 1807/4885KMT2A 41/4885

“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.