SCHEMBL2302847

SCHEMBL2302847

O=C(NC1CCNCC1)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.52
EPHX2 P34913 1/20 0.49
CHRM3 P20309 5/20 0.47
CHRM1 P11229 4/20 0.47
CHRM2 P08172 3/20 0.47
TLR2 O60603 2/20 0.44
FABP7 O15540 1/20 0.42
FABP5 Q01469 1/20 0.42
CASP3 P42574 1/20 0.42
ALDH1A1 P00352 1/20 0.41
GAA P10253 1/20 0.41

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
Hydrochloric Acid SCHEMBL30901456 0.99 KMT2A (0.51) KMT2AEPHX2CHRM3CHRM1CHRM2
Hydrochloric Acid SCHEMBL1560621 0.99 KMT2A (0.51) KMT2AEPHX2CHRM3CHRM1CHRM2
SCHEMBL7201578 0.95 KMT2A (0.48) KMT2AEPHX2CHRM3CHRM1CHRM2
SCHEMBL1256624 0.90 KMT2A (0.58) KMT2AEPHX2FABP7FABP5CASP3
SCHEMBL23841210 0.88 KMT2A (0.56) KMT2AEPHX2FABP7FABP5ALDH1A1
SCHEMBL10230770 0.86 KMT2A (0.54) KMT2AEPHX2ALDH1A1
SCHEMBL15705238 0.86 KMT2A (0.54) KMT2AEPHX2ALDH1A1
SCHEMBL13555711 0.86 KMT2A (0.54) KMT2AEPHX2ALDH1A1
SCHEMBL471502 0.86 KMT2A (0.54) KMT2AEPHX2ALDH1A1
SCHEMBL16248428 0.86 KMT2A (0.54) KMT2AEPHX2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250296915-A1 NOVEL AMINO ACID DERIVATIVES PEPTIDREAM INC (JP) 2025-09-25 US disclosed
US-12037336-B2 Compounds with activity as inhibitors of the epithelial sodium channel (ENaC) Enterprise Therapeutics Limited (GB) 2024-07-16 US disclosed
US-12037336-B2 Compounds with activity as inhibitors of the epithelial sodium channel (ENaC) Enterprise Therapeutics Limited (GB) 2024-07-16 US disclosed
US-20240067653-A1 BENZODIAZOLIUM COMPOUNDS AS ENAC INHIBITORS Enterprise Therapeutics Limited (GB) 2024-02-29 US disclosed
US-20240067653-A1 BENZODIAZOLIUM COMPOUNDS AS ENAC INHIBITORS Enterprise Therapeutics Limited (GB) 2024-02-29 US disclosed
US-11739094-B2 Substituted benzodiazoliums as ENaC inhibitors Enterprise Therapeutics Limited (GB) 2023-08-29 US disclosed
US-11739094-B2 Substituted benzodiazoliums as ENaC inhibitors Enterprise Therapeutics Limited (GB) 2023-08-29 US disclosed
EP-3794002-B1 COMPOUNDS ENTERPRISE THERAPEUTICS LTD (GB) 2023-08-02 EP disclosed
US-20210188855-A1 COMPOUNDS Enterprise Therapeutics Limited (GB) 2021-06-24 US disclosed
EP-3544981-B1 BENZODIAZOLIUM COMPOUNDS AS ENAC INHIBITORS ENTERPRISE THERAPEUTICS LTD (GB) 2021-06-23 EP disclosed
US-20210147432-A1 BENZODIAZOLIUM COMPOUNDS AS ENAC INHIBITORS Enterprise Therapeutics Limited (GB) 2021-05-20 US disclosed
US-10941149-B2 Substituted benzodiazoliums as ENaC inhibitors Enterprise Therapeutics Limited (GB) 2021-03-09 US disclosed
US-20190315757-A1 BENZODIAZOLIUM COMPOUNDS AS ENaC INHIBITORS Enterprise Therapeutics Limited (GB) 2019-10-17 US disclosed
WO-2018096325-A1 BENZODIAZOLIUM COMPOUNDS AS ENAC INHIBITORS Enterprise Therapeutics Limited (GB) 2018-05-31 WO disclosed
US-8003785-B2 Halo-substituted pyrimidodiazepines TAKEDA PHARMACEUTICAL COMPANY LIMITED (US) 2011-08-23 US disclosed
US-20090318408-A1 HALO-SUBSTITUTED PYRIMIDODIAZEPINES TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-12-24 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 (9 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-11739094-B2 Substituted benzodiazoliums as ENaC inhibitors NHERF1, SCNN1B, SCNN1A KMT2A 4337/4885EPHX2 4053/4885CHRM3 427/4885
US-20190315757-A1 BENZODIAZOLIUM COMPOUNDS AS ENaC INHIBITORS NHERF1, SCNN1B, SCNN1A KMT2A 4508/4885EPHX2 3856/4885CHRM3 557/4885
US-20250296915-A1 NOVEL AMINO ACID DERIVATIVES DNPEP, BCAT1, ANPEP KMT2A 2979/4885EPHX2 4775/4885CHRM3 4849/4885
US-12037336-B2 Compounds with activity as inhibitors of the epithelial sodium channel (ENaC) SCNN1B, SCNN1A, SCNN1G KMT2A 4545/4885EPHX2 3496/4885CHRM3 320/4885
US-20240067653-A1 BENZODIAZOLIUM COMPOUNDS AS ENAC INHIBITORS NHERF1, SCNN1B, SCNN1A KMT2A 4508/4885EPHX2 3856/4885CHRM3 557/4885
US-20090318408-A1 HALO-SUBSTITUTED PYRIMIDODIAZEPINES PLK1, CCNI, CDK1 KMT2A 663/4885EPHX2 3216/4885CHRM3 4268/4885
US-20210147432-A1 BENZODIAZOLIUM COMPOUNDS AS ENAC INHIBITORS NHERF1, SCNN1B, SCNN1A KMT2A 4508/4885EPHX2 3856/4885CHRM3 557/4885
US-20210188855-A1 COMPOUNDS NHERF1, SCNN1B, SCNN1A KMT2A 4270/4885EPHX2 3529/4885CHRM3 309/4885
US-10941149-B2 Substituted benzodiazoliums as ENaC inhibitors NHERF1, SCNN1B, SCNN1A KMT2A 4337/4885EPHX2 4053/4885CHRM3 427/4885

“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.