SCHEMBL2361603

SCHEMBL2361603

CCCCCN(C=O)C=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADH1C P00326 3/20 0.48
ADH1A P07327 3/20 0.48
ADH4 P08319 2/20 0.48
DNM1 Q05193 3/20 0.43
TSHR P16473 5/20 0.42
ADH1B P00325 2/20 0.39
ADH7 P40394 2/20 0.39
EPHX1 P07099 1/20 0.39
FAAH O00519 2/20 0.37
TRPV1 Q8NER1 2/20 0.37
THRB P10828 1/20 0.37
ALDH1A1 P00352 2/20 0.35
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
S1PR2 O95136 1/20 0.34
S1PR1 P21453 1/20 0.34
S1PR3 Q99500 1/20 0.34
S1PR5 Q9H228 1/20 0.34

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
SCHEMBL6704525 0.92
SCHEMBL27996809 0.87 ADH1C (0.44) ADH1CADH1AADH4DNM1TSHR
SCHEMBL3479880 0.85 ADH1C (0.42) ADH1CADH1AADH4DNM1TSHR
SCHEMBL27996576 0.85 ADH1C (0.47) ADH1CADH1AADH4DNM1TSHR
SCHEMBL16056007 0.85 ADH1C (0.42) ADH1CADH1AADH4DNM1TSHR
SCHEMBL5461538 0.84 ADH1C (0.46) ADH1CADH1AADH4DNM1TSHR
SCHEMBL8087321 0.84 ADH1C (0.46) ADH1CADH1AADH4DNM1TSHR
SCHEMBL8086267 0.84 ADH1C (0.46) ADH1CADH1AADH4DNM1TSHR
SCHEMBL5466491 0.84 ADH1C (0.46) ADH1CADH1AADH4DNM1TSHR
SCHEMBL8087564 0.84 ADH1C (0.46) ADH1CADH1AADH4DNM1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7122700-B2 Arylamine processes XEROX CORPORATION (US) 2006-10-17 US claimed
US-20060025631-A1 Arylamine processes XEROX CORPORATION 2006-02-02 US claimed
EP-3632441-B1 METHOD FOR PRODUCING OPTICALLY ACTIVE COMPOUND DAY ONE BIOPHARMACEUTICALS INC (US) 2024-07-17 EP disclosed
CN-118344346-A Heterocyclic compounds and their use 武田药品工业株式会社 2024-07-16 CN disclosed
EP-3782986-B1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICALS CO (JP) 2024-07-10 EP disclosed
CN-118290408-A Heterocyclic compounds and their use 武田药品工业株式会社 2024-07-05 CN disclosed
US-20240217957-A1 HETEROCYCLIC COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2024-07-04 US disclosed
US-12024505-B2 Heterocyclic compounds useful as modulators of acetylcholine receptors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2024-07-02 US disclosed
CN-118271298-A Heterocyclic compounds and their use 武田药品工业株式会社 2024-07-02 CN disclosed
CN-118271297-A Heterocyclic compounds and their use 武田药品工业株式会社 2024-07-02 CN disclosed
US-12012419-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2024-06-18 US disclosed
US-8008525-B2 For the 14273 peroxisome proliferator activated receptor; antidiabetic agents, hyperlipidemia, obesity or anorexia; receptor binding assay; drug screening kits TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-08-30 US disclosed
US-7608627-B2 I kappa B kinase inhibition; diabetes; (7-Chloro-1H-pyrrolo[2,3-c]pyridin-2-yl)methanol; N-Benzyl-7-chloro-1H-pyrrolo[2,3-c]pyridine-2-carboxamide TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-10-27 US disclosed
US-20080167378-A1 Receptor Function Regulation Agent TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-07-10 US disclosed
US-20080064715-A1 6-Azaindole Compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-03-13 US disclosed
EP-1732566-A2 6-AZAINDOLE COMPOUND Takeda Pharmaceutical Company Limited (JP) 2006-12-20 EP disclosed
US-7122700-B2 Arylamine processes XEROX CORPORATION (US) 2006-10-17 US disclosed
EP-1688138-A1 RECEPTOR FUNCTION REGULATING AGENT Takeda Pharmaceutical Company Limited (JP) 2006-08-09 EP disclosed
US-20060025631-A1 Arylamine processes XEROX CORPORATION 2006-02-02 US disclosed
WO-2005097129-A2 6-AZAINDOLE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2005-10-20 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 (6 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-20080167378-A1 Receptor Function Regulation Agent GPR119, INSR, GPR88 ADH1C 1992/4885ADH1A 1864/4885ADH4 2145/4885
US-20240217957-A1 HETEROCYCLIC COMPOUND AND USE THEREOF HCRTR2, HCRTR1, NPY2R ADH1C 838/4885ADH1A 1445/4885ADH4 2043/4885
US-12024505-B2 Heterocyclic compounds useful as modulators of acetylcholine receptors CHRM3, CHRNA1, CHRM5 ADH1C 899/4885ADH1A 1064/4885ADH4 1316/4885
US-12012419-B2 Heterocyclic compound SLC10A2, ALPI, SLC10A1 ADH1C 248/4885ADH1A 501/4885ADH4 628/4885
US-20080064715-A1 6-Azaindole Compound RELA, NFKBIA, GPR119 ADH1C 2106/4885ADH1A 2873/4885ADH4 2316/4885
US-20060025631-A1 Arylamine processes AHR, MAOA, MAOB ADH1C 1162/4885ADH1A 411/4885ADH4 381/4885

“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.