SCHEMBL5151197

SCHEMBL5151197

Cc1c(N)cccc1N=C1NCCN1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.45
TSHR P16473 1/20 0.45
PIK3CA P42336 1/20 0.45
ALDH1A1 P00352 1/20 0.38
NPC1 O15118 1/20 0.33
GAA P10253 1/20 0.33
RAB9A P51151 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CD44 P16070 1/20 0.32
PARP1 P09874 1/20 0.31
HPGD P15428 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL10880609 0.84 CYP3A4 (0.32) CYP3A4TSHRPIK3CA
SCHEMBL8623385 0.81 MAPT (0.39) CYP3A4ALDH1A1NPC1RAB9AL3MBTL1
SCHEMBL2525625 0.81 L3MBTL1 (0.48) CYP3A4TSHRALDH1A1NPC1GAA
Hydrochloric Acid SCHEMBL10856519 0.79 L3MBTL1 (0.46) CYP3A4ALDH1A1NPC1GAARAB9A
SCHEMBL10832383 0.79 POLB (0.42) CYP3A4ALDH1A1NPC1RAB9AL3MBTL1
SCHEMBL5155034 0.79 PARP10 (0.31) ALDH1A1
SCHEMBL8626163 0.76 TAAR1 (0.36) CYP3A4TSHRALDH1A1GAASMN1; SMN2
SCHEMBL5154211 0.76 KDM4E (0.37) GAA
Bromide SCHEMBL6726492 0.75 KDM4E (0.36) GAA
SCHEMBL8619688 0.73 USP2 (0.45) TSHRALDH1A1NPC1GAARAB9A

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 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0821585-B1 USE OF ALPHA 1L-AGONISTS IN THE TREATMENT OF URINARY INCONTINENCE BOEHRINGER INGELHEIM PHARMA (DE) 2007-01-10 EP claimed
US-7019021-B2 Compounds and methods for treating urinary incontinence BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2006-03-28 US claimed
US-20040198796-A1 Compounds and methods for treating urinary incontinence BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2004-10-07 US claimed
CN-1119148-C Use of 'alpha' 1L agonists in treatment of incontinence BOEHRINGER INGELHEIM KG (DE) 2003-08-27 CN claimed
US-20030114425-A1 Compounds and methods for treating urinary incontinence BOEHRINGER INGELHEIM PHARMA KG (DE) 2003-06-19 US claimed
EP-1285653-A1 Use of alpha-1L agonists in the treatment of incontinence Boehringer Ingelheim Pharma KG (DE) 2003-02-26 EP claimed
JP-3379960-B2 2003-02-24 JP claimed
US-20020040150-A1 SKIN TREATMENT COMPOSITONS CONTAINING A CATIONIC POLYMER AND A MICROPARTICLE OR NANOPARTICLE VECTOR ESSER FRANZ (DE) 2002-04-04 US claimed
US-6268389-B1 Treatment of urinary incontinence by administration of α1L-adrenoceptor agonists BOEHRINGER INGELHEIM KG (DE) 2001-07-31 US claimed
EP-0821585-A1 USE OF $g(a) 1L? AGONISTS IN THE TREATMENT OF INCONTINENCE BOEHRINGER INGELHEIM KG (DE) 1998-02-04 EP claimed
WO-1996032939-A1 USE OF α1L AGONISTS IN THE TREATMENT OF INCONTINENCE BOEHRINGER INGELHEIM KG (DE) 1996-10-24 WO claimed
US-8591947-B2 Dual controlled release dosage form Osmotica Kereskedelmi és Szolgáltató KFT (HU) 2013-11-26 US disclosed
US-20130108693-A1 Dual Controlled Release Dosage Form OSMOTICA KERESKEDELMI ES SZOLGALTATO KFT (HU) 2013-05-02 US disclosed
US-8329217-B2 Dual controlled release dosage form OSMOTICA KERESKEDELMI ES SZOLGALTATO KFT (HU) 2012-12-11 US disclosed
US-8241667-B2 Dual controlled release osmotic device Osmotica Kereskedelmi és Szolgáltató KFT (HU) 2012-08-14 US disclosed
EP-1285653-A1 Use of alpha-1L agonists in the treatment of incontinence Boehringer Ingelheim Pharma KG (DE) 2003-02-26 EP disclosed
US-20020040150-A1 SKIN TREATMENT COMPOSITONS CONTAINING A CATIONIC POLYMER AND A MICROPARTICLE OR NANOPARTICLE VECTOR ESSER FRANZ (DE) 2002-04-04 US disclosed
US-6268389-B1 Treatment of urinary incontinence by administration of α1L-adrenoceptor agonists BOEHRINGER INGELHEIM KG (DE) 2001-07-31 US disclosed
EP-0821585-A1 USE OF $g(a) 1L? AGONISTS IN THE TREATMENT OF INCONTINENCE BOEHRINGER INGELHEIM KG (DE) 1998-02-04 EP disclosed
WO-1996032939-A1 USE OF α1L AGONISTS IN THE TREATMENT OF INCONTINENCE BOEHRINGER INGELHEIM KG (DE) 1996-10-24 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-20030114425-A1 Compounds and methods for treating urinary incontinence PDE3A, PDE3B, PDE2A CYP3A4 3857/4885TSHR 2606/4885PIK3CA 4180/4885
US-20040198796-A1 Compounds and methods for treating urinary incontinence REN, ARG1, RXFP1 CYP3A4 1909/4885TSHR 4526/4885PIK3CA 4154/4885
US-20020040150-A1 SKIN TREATMENT COMPOSITONS CONTAINING A CATIONIC POLYMER AND A MICROPARTICLE OR NANOPARTICLE VECTOR COL1A1, TPSAB1, TACR1 CYP3A4 2807/4885TSHR 3011/4885PIK3CA 1894/4885

“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.