SCHEMBL4864771

SCHEMBL4864771

CC(Cc1ccc(Cl)cc1)C(C)NCCN1CCCCC1=O

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.40
LMNA P02545 2/20 0.39
ADAMTS5 Q9UNA0 1/20 0.39
WDR91 A4D1P6 1/20 0.39
USP2 O75604 1/20 0.39
RECQL P46063 1/20 0.39
P2RX3 P56373 1/20 0.38
KMT2A Q03164 3/20 0.38
ACHE P22303 1/20 0.38
HRH3 Q9Y5N1 1/20 0.38
RAB9A P51151 1/20 0.38
GAA P10253 1/20 0.37
KCNH2 Q12809 1/20 0.37

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
SCHEMBL4875126 0.87 DPP7 (0.39) L3MBTL1LMNAADAMTS5WDR91USP2
SCHEMBL4876049 0.81 KMT2A (0.47) LMNAKMT2ARAB9A
SCHEMBL4875549 0.80 RAB9A (0.41) LMNAUSP2RECQLKMT2AHRH3
SCHEMBL4875416 0.79 MEN1 (0.44) LMNAKMT2ARAB9A
SCHEMBL4865436 0.73 RAB9A (0.41) L3MBTL1LMNAADAMTS5USP2RECQL
SCHEMBL4871367 0.73 HPGD (0.50) USP2KMT2ARAB9AGAA
SCHEMBL18893369 0.73 KMT2A (0.53) KMT2ARAB9A
SCHEMBL4864762 0.73 ADAMTS5 (0.44) L3MBTL1LMNAADAMTS5WDR91P2RX3
SCHEMBL4875116 0.72 ADAMTS5 (0.43) L3MBTL1LMNAADAMTS5WDR91P2RX3
SCHEMBL13167407 0.71 KMT2A (0.57) KMT2ARAB9A

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7361648-B2 Heterocyclylakylamines as muscarinic receptor antagonists ROCHE PALO ALTO LLC (US) 2008-04-22 US disclosed
US-20060287293-A1 Heterocyclylalkylamines as muscarinic receptor antagonists ROCHE PALO ALTO LLC 2006-12-21 US disclosed
US-7094778-B2 Heterocyclylalkylamines as muscarinic receptor antagonists SYNTEX (U.S.A.) LLC (US) 2006-08-22 US disclosed
EP-1289965-B1 SUBSTITUTED 1-AMINOALKYL-LACTAMS AND THEIR USE AS MUSCARINIC RECEPTOR ANTAGONISTS HOFFMANN LA ROCHE (CH) 2005-10-26 EP disclosed
US-20040087581-A1 Heterocyclylalkylamines as muscarinic receptor antagonists DVORAK CHARLES ALOIS (US) 2004-05-06 US disclosed
US-6667301-B2 Therapy for muscular disorders, urogenital disorders, gastrointestinal disorders, respiratory system disorders SYNTEX (U.S.A.) LLC 2003-12-23 US disclosed
EP-1289965-A1 SUBSTITUTED 1-AMINOALKYL-LACTAMS AND THEIR USE AS MUSCARINIC RECEPTOR ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2003-03-12 EP disclosed
US-20020004501-A1 Heterocyclylalkylamines as muscarinic receptor antagonists SYNTEX (U.S.A.) LLC 2002-01-10 US disclosed
WO-2001090081-A1 SUBSTITUTED 1-AMINOALKYL-LACTAMS AND THEIR USE AS MUSCARINIC RECEPTOR ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2001-11-29 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 (3 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-20060287293-A1 Heterocyclylalkylamines as muscarinic receptor antagonists CHRM5, CHRM2, CHRM3 L3MBTL1 2437/4885LMNA 3315/4885ADAMTS5 1839/4885
US-20020004501-A1 Heterocyclylalkylamines as muscarinic receptor antagonists CHRM5, CHRM2, CHRM1 L3MBTL1 2339/4885LMNA 3391/4885ADAMTS5 2297/4885
US-20040087581-A1 Heterocyclylalkylamines as muscarinic receptor antagonists CHRM5, CHRM2, CHRM1 L3MBTL1 2339/4885LMNA 3391/4885ADAMTS5 2297/4885

“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.