SCHEMBL5898502

SCHEMBL5898502

Cc1c(NC(N)=S)cccc1N(C)C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.47
L3MBTL1 Q9Y468 3/20 0.44
ALDH1A1 P00352 6/20 0.44
GAA P10253 3/20 0.43
KMT2A Q03164 3/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
KDM4E B2RXH2 2/20 0.42
MEN1 O00255 2/20 0.42
CYP1A2 P05177 3/20 0.42
CYP3A4 P08684 2/20 0.41
MAPK1 P28482 1/20 0.41
LMNA P02545 1/20 0.41
GLA P06280 1/20 0.40
POLB P06746 1/20 0.39
TP53 P04637 1/20 0.37
TYR P14679 1/20 0.37
TSHR P16473 1/20 0.37
TAS2R38 P59533 1/20 0.37
HSD17B10 Q99714 1/20 0.37
CYP2D6 P10635 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
SCHEMBL7814232 0.84 L3MBTL1 (0.53) MAPTL3MBTL1ALDH1A1GAAKMT2A
SCHEMBL30356302 0.84 L3MBTL1 (0.53) MAPTL3MBTL1ALDH1A1GAAKMT2A
SCHEMBL5447861 0.78 ALDH1A1 (0.68) MAPTL3MBTL1ALDH1A1GAAKMT2A
SCHEMBL29838620 0.78 ALDH1A1 (0.68) MAPTL3MBTL1ALDH1A1GAAKMT2A
SCHEMBL11166274 0.78 L3MBTL1 (0.47) MAPTL3MBTL1ALDH1A1GAAKMT2A
SCHEMBL14369899 0.77 L3MBTL1 (0.48) MAPTL3MBTL1ALDH1A1GAAKMT2A
SCHEMBL18550739 0.77 L3MBTL1 (0.48) MAPTL3MBTL1ALDH1A1GAAKMT2A
SCHEMBL27547230 0.76 MAPT (0.44) MAPTL3MBTL1ALDH1A1GAAKMT2A
SCHEMBL6676214 0.76 MAPT (0.44) MAPTL3MBTL1ALDH1A1GAAKMT2A
SCHEMBL18550663 0.75 ALDH1A1 (0.61) MAPTL3MBTL1ALDH1A1GAAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7019021-B2 Compounds and methods for treating urinary incontinence BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2006-03-28 US disclosed
US-6858594-B2 Compounds and methods for treating urinary incontinence BOEHRINGER INGELHEIM PHARMA GMBH & CO KG. (DE) 2005-02-22 US disclosed
US-20040198796-A1 Compounds and methods for treating urinary incontinence BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2004-10-07 US disclosed
CN-1119148-C Use of 'alpha' 1L agonists in treatment of incontinence BOEHRINGER INGELHEIM KG (DE) 2003-08-27 CN disclosed
US-20030114425-A1 Compounds and methods for treating urinary incontinence BOEHRINGER INGELHEIM PHARMA KG (DE) 2003-06-19 US 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

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 MAPT 2876/4885L3MBTL1 3507/4885ALDH1A1 181/4885
US-20040198796-A1 Compounds and methods for treating urinary incontinence REN, ARG1, RXFP1 MAPT 2124/4885L3MBTL1 3906/4885ALDH1A1 28/4885
US-20020040150-A1 SKIN TREATMENT COMPOSITONS CONTAINING A CATIONIC POLYMER AND A MICROPARTICLE OR NANOPARTICLE VECTOR COL1A1, TPSAB1, TACR1 MAPT 875/4885L3MBTL1 1080/4885ALDH1A1 636/4885

“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.