SCHEMBL336826

SCHEMBL336826

CCCC(N(C)CCC(c1ccccc1)c1ccccc1)C(C)(C)OC(=O)C1=C(C)NC(C)=C(C(=O)OC(C)(C)C(CCC)N(C)CCC(c2ccccc2)c2ccccc2)C1c1cccc([N+](=O)[O-])c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 3/20 0.68
ADRA1A P35348 2/20 0.68
MTOR P42345 2/20 0.68
RAB9A P51151 2/20 0.68
SLC6A3 Q01959 2/20 0.68
MLNR O43193 1/20 0.68
NR1I2 O75469 1/20 0.68
CNR1 P21554 1/20 0.68
HRH1 P35367 1/20 0.68
OPRK1 P41145 1/20 0.68
PDE3A Q14432 1/20 0.68
NR3C2 P08235 1/20 0.55
CACNA1C Q13936 8/20 0.54
CACNA1F O60840 7/20 0.54
CACNA1D Q01668 7/20 0.54
CACNA1S Q13698 7/20 0.54
PDE1C Q14123 1/20 0.53
CYP1A2 P05177 5/20 0.51
CYP3A4 P08684 5/20 0.51
CYP2C9 P11712 5/20 0.51

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
SCHEMBL1434764 0.90 ADORA3 (0.71) ADORA3ADRA1AMTORRAB9ASLC6A3
SCHEMBL1434762 0.88 ADORA3 (0.68) ADORA3ADRA1AMTORRAB9ASLC6A3
SCHEMBL1434767 0.88 ADORA3 (0.68) ADORA3ADRA1AMTORRAB9ASLC6A3
SCHEMBL5275957 0.82 ADORA3 (0.90) ADORA3ADRA1AMTORRAB9ASLC6A3
SCHEMBL7590320 0.82 ADORA3 (0.90) ADORA3ADRA1AMTORRAB9ASLC6A3
SCHEMBL8237206 0.82 ADORA3 (0.83) ADORA3ADRA1AMTORRAB9ASLC6A3
Lercanidipine SCHEMBL25268 0.81 ADORA3 (1.00) ADORA3ADRA1AMTORRAB9ASLC6A3
Lercanidipine SCHEMBL9957683 0.81 ADORA3 (1.00) ADORA3ADRA1AMTORRAB9ASLC6A3
Lercanidipine SCHEMBL8415026 0.81 ADORA3 (1.00) ADORA3ADRA1AMTORRAB9ASLC6A3
Lercanidipine SCHEMBL25269 0.81 ADORA3 (1.00) ADORA3ADRA1AMTORRAB9ASLC6A3

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-8097729-B2 Polymorphic form of lercanidipine hydrochloride and process for the preparation thereof GLENMARK GENERICS LTD. (IN) 2012-01-17 US claimed
US-20090221833-A1 Polymorphic Form of Lercanidipine Hydrochloride and Process for the Preparation Thereof ALIVUS LIFE SCIENCES LIMITED (IN) 2009-09-03 US claimed
EP-1940790-A2 POLYMORPHIC FORM OF LERCANIDIPINE HYDROCHLORIDE AND PROCESS FOR THE PREPARATION THEREOF Glenmark Pharmaceuticals Limited (IN) 2008-07-09 EP claimed
WO-2007031865-A2 POLYMORPHIC FORM OF LERCANIDIPINE HYDROCHLORIDE AND PROCESS FOR THE PREPARATION THEREOF GLENMARK PHARMACEUTICALS LIMITED (US) 2007-03-22 WO claimed
EP-1940790-B1 POLYMORPHIC FORM OF LERCANIDIPINE HYDROCHLORIDE AND PROCESS FOR THE PREPARATION THEREOF GLENMARK PHARMACEUTICALS LTD (IN) 2015-09-02 EP disclosed
US-8097729-B2 Polymorphic form of lercanidipine hydrochloride and process for the preparation thereof GLENMARK GENERICS LTD. (IN) 2012-01-17 US disclosed
US-20090221833-A1 Polymorphic Form of Lercanidipine Hydrochloride and Process for the Preparation Thereof ALIVUS LIFE SCIENCES LIMITED (IN) 2009-09-03 US disclosed
EP-1940790-A2 POLYMORPHIC FORM OF LERCANIDIPINE HYDROCHLORIDE AND PROCESS FOR THE PREPARATION THEREOF Glenmark Pharmaceuticals Limited (IN) 2008-07-09 EP disclosed
WO-2007031865-A2 POLYMORPHIC FORM OF LERCANIDIPINE HYDROCHLORIDE AND PROCESS FOR THE PREPARATION THEREOF GLENMARK PHARMACEUTICALS LIMITED (US) 2007-03-22 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-20090221833-A1 Polymorphic Form of Lercanidipine Hydrochloride and Process for the Preparation Thereof ADH1C, ADH5, CYP3A4 ADORA3 1998/4885ADRA1A 49/4885MTOR 4168/4885

“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.