SCHEMBL4876200

SCHEMBL4876200

C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOCC1

nearest known ligand 0.77

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.59
KMT2A Q03164 1/20 0.59
NPSR1 Q6W5P4 1/20 0.59
PREP P48147 2/20 0.56
CYP1A2 P05177 1/20 0.52
ATM Q13315 1/20 0.51
CCR1 P32246 2/20 0.51
CAPN1 P07384 2/20 0.50
MMP8 P22894 1/20 0.50
CTSK P43235 4/20 0.49
CTSL P07711 3/20 0.49
CTSB P07858 2/20 0.49
CTSS P25774 1/20 0.49
ELANE P08246 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
SCHEMBL11261467 0.91 PREP (0.61) MEN1KMT2APREPCYP1A2ATM
SCHEMBL8206101 0.91 PREP (0.61) MEN1KMT2APREPCYP1A2ATM
SCHEMBL11254461 0.91 PREP (0.61) MEN1KMT2APREPCYP1A2ATM
SCHEMBL8206098 0.91 PREP (0.61) MEN1KMT2APREPCYP1A2ATM
SCHEMBL9510140 0.89 PREP (0.62) PREPCYP1A2ATMCCR1CTSK
SCHEMBL27514276 0.88 CCR1 (0.65) MEN1KMT2ANPSR1ATMCCR1
SCHEMBL13798752 0.85 MEN1 (0.55) MEN1KMT2ANPSR1PREPCYP1A2
SCHEMBL25186498 0.83 MEN1 (0.56) MEN1KMT2ANPSR1MMP8
SCHEMBL8238323 0.83 MEN1 (0.56) MEN1KMT2ANPSR1CCR1MMP8
SCHEMBL6584060 0.82 PREP (0.59) MEN1KMT2APREPCYP1A2CCR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016067194-A1 PROCESS FOR THE PREPARATION OF ANACETRAPIB AND AN INTERMEDIATE THEREOF SUN PHARMACEUTICAL INDUSTRIES LIMITED (IN) 2016-05-06 WO disclosed
WO-2014111953-A1 PROCESS FOR PREPARATION OF ANACETRAPIB AND INTERMEDIATES THEREOF GLENMARK PHARMACEUTICALS LIMITED; GLENMARK GENERICS LIMITED (IN) 2014-07-24 WO disclosed
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 MEN1 1954/4885KMT2A 1941/4885NPSR1 57/4885
US-20020004501-A1 Heterocyclylalkylamines as muscarinic receptor antagonists CHRM5, CHRM2, CHRM1 MEN1 1892/4885KMT2A 2014/4885NPSR1 42/4885
US-20040087581-A1 Heterocyclylalkylamines as muscarinic receptor antagonists CHRM5, CHRM2, CHRM1 MEN1 1892/4885KMT2A 2014/4885NPSR1 42/4885

“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.