SCHEMBL6929598

SCHEMBL6929598

COCC1=C(C(=O)OC)C(c2cccc(Cl)c2)C(C(=O)NCCC(c2ccccc2)c2ccccc2)=C(COCCN)N1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CACNA1B Q00975 8/20 0.49
ADRA1A P35348 5/20 0.44
ADRA2A P08913 4/20 0.44
SLC6A3 Q01959 3/20 0.44
ADRA2C P18825 3/20 0.44
ADRA1D P25100 3/20 0.44
ADRA1B P35368 3/20 0.44
HTR1A P08908 2/20 0.44
CHRM1 P11229 2/20 0.44
DRD1 P21728 2/20 0.44
TBXA2R P21731 2/20 0.44
SLC6A2 P23975 2/20 0.44
OPRM1 P35372 2/20 0.44
DRD3 P35462 2/20 0.44
KCNH2 Q12809 2/20 0.44
ADORA3 P0DMS8 2/20 0.44
OPRK1 P41145 2/20 0.44
KCNK2 O95069 1/20 0.44
ABCB11 O95342 1/20 0.44
ADRB2 P07550 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
SCHEMBL14500659 0.94 CACNA1B (0.47) CACNA1BADRA1AADRA2ASLC6A3ADRA2C
SCHEMBL6929475 0.94 CACNA1B (0.52) CACNA1BADRA1AADRA2ASLC6A3ADRA2C
SCHEMBL6931100 0.94 CACNA1B (0.49) CACNA1BADRA1AADRA2ASLC6A3ADRA2C
SCHEMBL6931083 0.94 CACNA1B (0.56) CACNA1BADRA1AADRA2ASLC6A3ADRA2C
SCHEMBL6929235 0.91 CACNA1B (0.49) CACNA1BADRA1AADRA2ASLC6A3ADRA2C
SCHEMBL6929484 0.87 CACNA1B (0.56) CACNA1BADRA1AADRA2ASLC6A3ADRA2C
SCHEMBL4502482 0.87 CACNA1B (0.59) CACNA1BADRA1AADRA2ASLC6A3ADRA2C
SCHEMBL6929379 0.85 CACNA1B (0.49) CACNA1BADRA1ACACNA1CCASRMEN1
SCHEMBL6930161 0.83 CACNA1B (0.46) CACNA1BADRA1AADRA2ASLC6A3ADRA2C
SCHEMBL7750506 0.83 CACNA1B (0.46) CACNA1BADRA1AADRA2ASLC6A3ADRA2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7459430-B2 Methods of using ziconotide to treat overactive bladder DYNOGEN PHARMACEUTICALS, INC. (US) 2008-12-02 US disclosed
US-7459430-B2 Methods of using ziconotide to treat overactive bladder DYNOGEN PHARMACEUTICALS, INC. (US) 2008-12-02 US disclosed
US-7223754-B2 Thiazolidinone, oxazolidinone, and imidazolone derivatives for treating lower urinary tract and related disorders DYNOGEN PHARMACEUTICALS, INC. (US) 2007-05-29 US disclosed
US-20070105785-A1 Methods of treating non-inflammatory gastrointestinal tract disorders using Cav2.2 subunit calcium channel modulators DYNOGEN PHARMACEUTICALS, INC. (US) 2007-05-10 US disclosed
US-20070066597-A1 Thiazolidinone, oxazolidinone, and imidazolone derivatives for treating lower urinary tract and related disorders DYNOGEN PHARMACEUTICALS, INC. (US) 2007-03-22 US disclosed
WO-2005000285-A2 METHODS OF TREATING NON-INFLAMMATORY GASTROINTESTINAL TRACT DISORDERS USING Cav2.2 SUBUNIT CALCIUM CHANNEL MODULATORS DYNOGEN PHARMACEUTICALS, INC. (US) 2005-01-06 WO disclosed
US-6610717-B2 Selectively inhibits action of N-type calcium channel; treatment of ischemic cerebrovascular disorders caused by cerebral infarction or intracerebral bleeding, Alzheimer's disease, AIDS related dementia, Parkinson's disease AJINOMOTO CO., INC. (JP) 2003-08-26 US disclosed
US-6610717-B2 Selectively inhibits action of N-type calcium channel; treatment of ischemic cerebrovascular disorders caused by cerebral infarction or intracerebral bleeding, Alzheimer's disease, AIDS related dementia, Parkinson's disease AJINOMOTO CO., INC. (JP) 2003-08-26 US disclosed
US-20020193605-A1 New dihydropyridine derivatives AJINOMOTO CO. INC (JP) 2002-12-19 US disclosed
EP-1191022-A1 NOVEL DIHYDROPYRIDINE DERIVATIVE Ajinomoto Co., Inc. (JP) 2002-03-27 EP 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-20070105785-A1 Methods of treating non-inflammatory gastrointestinal tract disorders using Cav2.2 subunit calcium channel modulators CACNB2, RYR2, FABP2 CACNA1B 7/4885ADRA1A 1205/4885ADRA2A 309/4885
US-20020193605-A1 New dihydropyridine derivatives CACNA1B, CACNA1D, CACNA1C CACNA1B 1/4885ADRA1A 390/4885ADRA2A 349/4885
US-20070066597-A1 Thiazolidinone, oxazolidinone, and imidazolone derivatives for treating lower urinary tract and related disorders RYR2, CACNB2, CACNA1I CACNA1B 10/4885ADRA1A 1004/4885ADRA2A 338/4885

“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.