SCHEMBL5457624

SCHEMBL5457624

CCCN(CCC)N(CC)CC

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CA1 P00915 4/20 0.33
CA12 O43570 3/20 0.32
CA2 P00918 3/20 0.32
CA9 Q16790 2/20 0.32
CA14 Q9ULX7 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
SCHEMBL10583329 0.92 CA1 (0.33) CA1CA12CA2CA9CA14
SCHEMBL10875768 0.92 CA1 (0.33) CA1CA12CA2CA9CA14
SCHEMBL3279296 0.88 CA1 (0.39) CA1CA12CA2CA9CA14
SCHEMBL7770093 0.81
Hydrochloric Acid SCHEMBL3589378 0.79 DNM1 (0.35) CA1
SCHEMBL9579090 0.79 TSHR (0.38) CA1CA12CA2CA9
SCHEMBL9112091 0.78
SCHEMBL4506753 0.78 MGLL (0.36)
SCHEMBL10364721 0.76
SCHEMBL21442584 0.76

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0191335-B1 PREPARATION PROCESS OF (6R)-TETRAHYDRO-L-BIOPTERIN SHIRATORI PHARMACEUTICAL CO. LTD. (JP) 1991-08-14 EP claimed
EP-0222254-A2 Nicotinic-acid derivatives BAYER AG (DE) 1987-05-20 EP claimed
EP-0076199-A2 Triazoloquinazolones and their salts, process and intermediates for preparing them, their use as medicines and compositions containing them ROUSSEL-UCLAF (FR) 1983-04-06 EP claimed
CN-115867541-A Aminopyrimidinone derivatives 豪夫迈·罗氏有限公司 2023-03-28 CN disclosed
CN-114133521-A Preparation method of semicrystalline shape memory polymer and polyurethane elastic fiber 连云港杜钟新奥神氨纶有限公司 2022-03-04 CN disclosed
US-10622570-B2 Organic electroluminescent element NIPPON STEEL CHEMICAL & MATERIAL CO., LTD. (JP) 2020-04-14 US disclosed
US-10550393-B2 Method for stabilizing DNA aptamers TAGCYX BIOTECHNOLOGIES (JP) 2020-02-04 US disclosed
US-20190088883-A1 ORGANIC ELECTROLUMINESCENT ELEMENT NIPPON STEEL & SUMIKIN CHEMICAL CO., LTD. (JP) 2019-03-21 US disclosed
EP-3439058-A1 ORGANIC ELECTROLUMINESCENT ELEMENT Nippon Steel & Sumikin Chemical Co., Ltd. (JP) 2019-02-06 EP disclosed
CN-108602688-A METHOD FOR PRODUCING VANADIUM DIOXIDE PARTICLES 柯尼卡美能达株式会社 2018-09-28 CN disclosed
EP-3144313-A1 COBALT COMPOUND, RAW MATERIAL FOR FORMING THIN FILM, AND METHOD FOR PRODUCING THIN FILM Adeka Corporation (JP) 2017-03-22 EP disclosed
EP-0589341-B1 Process for the preparation von endo/exo-8-N,N-dialkylaminoexo-tricyclo(5.2.1.0 2,6) decane HOECHST AG (DE) 1997-01-02 EP disclosed
WO-1996000755-A1 CATHODIC ELECTROCOATING COMPOSITIONS CONTAINING BRANCHED EPOXY AMINE RESINS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1996-01-11 WO disclosed
US-5447974-A Blending an epoxy resin amine adduct, blocking with polyisocyanate crosslinking agent and adding pigment E. I. DU PONT DE NEMOURS AND COMPANY (US) 1995-09-05 US disclosed
US-5427857-A Improved throw power, corrosion resistance E. I. DU PONT DE NEMOURS AND COMPANY (US) 1995-06-27 US disclosed
EP-0596125-A1 CONDENSED THIOPHENE COMPOUND AND PHARMACEUTICAL USE THEREOF YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1994-05-11 EP disclosed
EP-0589341-A1 Process for the preparation von endo/exo-8-N,N-dialkylaminoexo-tricyclo(5.2.1.0 2,6) decane HOECHST AKTIENGESELLSCHAFT (DE) 1994-03-30 EP disclosed
US-4868076-A AMORPHOUS SILICON-GERMANIUM LAYER AND AMORPHOUS CARBON CONTAINING HYDROGEN LAYER MINOLTA CAMERA KABUSHIKI KAISHA (JP) 1989-09-19 US disclosed
EP-0222254-A2 Nicotinic-acid derivatives BAYER AG (DE) 1987-05-20 EP disclosed
EP-0024510-A1 Phenoxypropyl amine derivatives, process for their preparation, and pharmaceutical compositions containing them TEIKOKU HORMONE MFG. CO., LTD. (JP) 1981-03-11 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 (1 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-10622570-B2 Organic electroluminescent element NR2E3, ESR1, NCOR2 CA1 2049/4885CA12 2453/4885CA2 1498/4885

“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.