SCHEMBL351979

SCHEMBL351979

c1ccc2c(c1)ccc1cccc[n+]12

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TNNI3 P19429 1/20 0.61
TNNT2 P45379 1/20 0.61
TNNC1 P63316 1/20 0.61
MEN1 O00255 1/20 0.56
USP2 O75604 1/20 0.56
RAB9A P51151 1/20 0.56
KMT2A Q03164 1/20 0.56
RXFP1 Q9HBX9 1/20 0.56
CSNK2A2 P19784 4/20 0.44
CSNK2B P67870 4/20 0.44
CSNK2A1 P68400 4/20 0.44
BCHE P06276 9/20 0.42
ACHE P22303 9/20 0.42

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
SCHEMBL29798812 1.00 TNNI3 (0.61) TNNI3TNNT2TNNC1MEN1USP2
Hydrochloric Acid SCHEMBL7239186 0.77 TNNI3 (0.60) TNNI3TNNT2TNNC1MEN1USP2
Hydrochloric Acid SCHEMBL7240577 0.69 CSNK2A2 (0.54) TNNI3TNNT2TNNC1MEN1USP2
SCHEMBL11540737 0.68 TNNI3 (0.33) TNNI3TNNT2TNNC1MEN1USP2
SCHEMBL11637101 0.65 ALDH1A1 (0.44) RAB9ACSNK2A2CSNK2BCSNK2A1ACHE
SCHEMBL11536506 0.64 ACHE (0.34) BCHEACHE
SCHEMBL6946923 0.64 ACHE (0.34) TNNI3TNNT2TNNC1MEN1KMT2A
Hydrochloric Acid SCHEMBL18096521 0.64 CSNK2A2 (0.49) TNNI3TNNT2TNNC1MEN1USP2
SCHEMBL7801316 0.64 ACHE (0.41) BCHEACHE
SCHEMBL8739989 0.60 CSNK2A2 (0.50) CSNK2A2CSNK2BCSNK2A1ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190117683-A1 ALGINATE OLIGOMERS FOR THE TREATMENT OR PREVENTION OF MICROBIAL OVERGROWTH IN THE INTESTINAL TRACT ALGIPHARMA AS (NO) 2019-04-25 US claimed
US-20180055873-A1 USE OF ALGINATE OLIGOMERS AND CFTR MODULATORS IN THE TREATMENT OF CONDITIONS ASSOCIATED WITH CFTR DYSFUNCTION ALGIPHARMA AS (NO) 2018-03-01 US claimed
EP-3273995-A1 USE OF ALGINATE OLIGOMERS AND CFTR MODULATORS IN THE TREATMENT OF CONDITIONS ASSOCIATED WITH CFTR DYSFUNCTION ALGIPHARMA AS (NO) 2018-01-31 EP claimed
WO-2017060388-A1 ALGINATE OLIGOMERS FOR THE TREATMENT OR PREVENTION OF MICROBIAL OVERGROWTH IN THE INTESTINAL TRACT ALGIPHARMA AS (NO) 2017-04-13 WO claimed
US-20170044590-A1 METHODS FOR DETECTION AND TREATMENT OF NEURODEGENERATIVE DISEASES UNIVERSITY OF NOTRE DAME DU LAC 2017-02-16 US claimed
WO-2016151051-A1 USE OF ALGINATE OLIGOMERS AND CFTR MODULATORS IN THE TREATMENT OF CONDITIONS ASSOCIATED WITH CFTR DYSFUNCTION ALGIPHARMA AS (NO) 2016-09-29 WO claimed
WO-2015042326-A2 METHODS FOR DETECTION AND TREATMENT OF NEURODEGENERATIVE DISEASES UNIVERSITY OF NOTRE DAME DU LAC (US) 2015-03-26 WO claimed
EP-1792605-A1 Use of at least a cationic cyanine derivative for use in hair dyeing, composition containg it process of treating keratinic fibres using the same composition, kit and use thereof L'Oréal (FR) 2007-06-06 EP claimed
EP-1509520-B1 USE OF BENZO(C)QUINOLIZINIUM DERIVATIVES FOR THE TREATMENT OF DISEASES THAT ARE LINKED TO SMOOTH MUSCLE CELL CONSTRICTION CENTRE NAT RECH SCIENT (FR) 2006-11-22 EP claimed
US-20050176747-A1 Use of benzo[c]quinolizinium derivatives for the treatment of diseases that are linked to smooth muscle cell constriction CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2005-08-11 US claimed
EP-1509520-A1 USE OF BENZO(C)QUINOLIZINIUM DERIVATIVES FOR THE TREATMENT OF DISEASES THAT ARE LINKED TO SMOOTH MUSCLE CELL CONSTRICTION CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2005-03-02 EP claimed
WO-2003104228-A1 USE OF BENZO[C]QUINOLIZINIUM DERIVATIVES FOR THE TREATMENT OF DISEASES THAT ARE LINKED TO SMOOTH MUSCLE CELL CONSTRICTION CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2003-12-18 WO claimed
US-6630482-B1 Cystic fibrosis CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2003-10-07 US claimed
EP-0937044-B1 CFTR CHANNEL ACTIVATOR COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME CENTRE NAT RECH SCIENT (FR) 2002-01-30 EP claimed
EP-0937044-A1 CFTR CHANNEL ACTIVATOR COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 1999-08-25 EP claimed
WO-1998005642-A1 CFTR CHANNEL ACTIVATOR COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 1998-02-12 WO claimed
US-12508231-B2 Formulations of 3-(6-(1-(2,2-difluorobenzo[d][1,3]dioxol-5-yl) cyclopropanecarboxamido)-3-methylpyridin-2-yl)benzoic acid VERTEX PHARMACEUTICALS INCORPORATED (US) 2025-12-30 US disclosed
US-20250205232-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VERTEX PHARMACEUTICALS INCORPORATED (US) 2025-06-26 US disclosed
WO-1998005642-A1 CFTR CHANNEL ACTIVATOR COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 1998-02-12 WO disclosed
WO-1998005642-A1 CFTR CHANNEL ACTIVATOR COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 1998-02-12 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-20250205232-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR CFTR, SCNN1B, SLC26A4 TNNI3 2327/4885TNNT2 3233/4885TNNC1 3911/4885
US-20050176747-A1 Use of benzo[c]quinolizinium derivatives for the treatment of diseases that are linked to smooth muscle cell constriction MYLK, MYLK2, TNNI3 TNNI3 3/4885TNNT2 5/4885TNNC1 46/4885
US-12508231-B2 Formulations of 3-(6-(1-(2,2-difluorobenzo[d][1,3]dioxol-5-yl) cyclopropanecarboxamido)-3-methylpyridin-2-yl)benzoic acid CFTR, MFAP1, CMA1 TNNI3 3823/4885TNNT2 2308/4885TNNC1 336/4885

“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.