SCHEMBL6376756

SCHEMBL6376756

CCN(CC)c1ccc(NC(=O)[C@@H](Cc2ccccc2)NC(=O)Nc2ccc(Cl)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPY1R P25929 1/20 0.56
NPY2R P49146 1/20 0.56
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
NOX1 Q9Y5S8 2/20 0.55
NPC1 O15118 1/20 0.55
RAB9A P51151 1/20 0.55
CNR1 P21554 1/20 0.54
GAA P10253 1/20 0.54
MAPT P10636 1/20 0.54
HTT P42858 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
FPR2 P25090 10/20 0.52
F7 P08709 1/20 0.51
MMP1 P03956 1/20 0.50
S1PR1 P21453 1/20 0.48

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
SCHEMBL6376376 1.00 NPY1R (0.56) NPY1RNPY2RMEN1KMT2ANOX1
SCHEMBL6376369 1.00 NPY1R (0.56) NPY1RNPY2RMEN1KMT2ANOX1
SCHEMBL6376414 0.90 F7 (0.62) MEN1KMT2ANOX1NPC1RAB9A
SCHEMBL6376244 0.90 F7 (0.62) MEN1KMT2ANOX1NPC1RAB9A
SCHEMBL6376248 0.90 F7 (0.62) MEN1KMT2ANOX1NPC1RAB9A
SCHEMBL6376157 0.82 MEN1 (0.59) NPY1RNPY2RMEN1KMT2ANOX1
SCHEMBL6376149 0.82 MEN1 (0.59) NPY1RNPY2RMEN1KMT2ANOX1
SCHEMBL18983568 0.81 SMN1; SMN2 (0.56) MEN1KMT2AGAAMAPTSMN1; SMN2
SCHEMBL6379132 0.81 FPR2 (0.76) MEN1KMT2ANPC1RAB9ACNR1
SCHEMBL3450270 0.81 FPR2 (0.76) MEN1KMT2ANPC1RAB9ACNR1

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-20050137230-A1 Carboxamide derivatives DORSCH DIETER (DE) 2005-06-23 US claimed
US-20040038858-A1 Carboxamide derivatives and their use in the treatment of thromboembolic diseases and tumours MERCK PATENT GMBH (DE) 2004-02-26 US claimed
US-20050137230-A1 Carboxamide derivatives DORSCH DIETER (DE) 2005-06-23 US disclosed
US-20040038858-A1 Carboxamide derivatives and their use in the treatment of thromboembolic diseases and tumours MERCK PATENT GMBH (DE) 2004-02-26 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 (2 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-20050137230-A1 Carboxamide derivatives F11, F12, F2 NPY1R 61/4885NPY2R 546/4885MEN1 218/4885
US-20040038858-A1 Carboxamide derivatives and their use in the treatment of thromboembolic diseases and tumours CNR2, CNR1, HCAR2 NPY1R 31/4885NPY2R 12/4885MEN1 3354/4885

“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.