SCHEMBL3073650

SCHEMBL3073650

NCCCC(CCO)CCO

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.39
ALDH1A1 P00352 1/20 0.39
CPB2 Q96IY4 1/20 0.34
NFKB1 P19838 1/20 0.33
GSR P00390 1/20 0.32
HTR2A P28223 1/20 0.32
HRH1 P35367 1/20 0.32
CA12 O43570 2/20 0.32
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32
CA3 P07451 2/20 0.32
CA4 P22748 2/20 0.32
CA6 P23280 2/20 0.32
CA5A P35218 2/20 0.32
CA7 P43166 2/20 0.32
CA9 Q16790 2/20 0.32
CA14 Q9ULX7 2/20 0.32
CA5B Q9Y2D0 2/20 0.32
DNM1 Q05193 1/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL14830612 0.92 GSR (0.33) TSHRALDH1A1CPB2GSRLMNA
SCHEMBL3068723 0.92 GSR (0.41) TSHRALDH1A1CPB2NFKB1GSR
SCHEMBL1684293 0.89 DNM1 (0.42) TSHRALDH1A1CPB2NFKB1GSR
SCHEMBL474837 0.89 DNM1 (0.42) TSHRALDH1A1CPB2NFKB1GSR
SCHEMBL8077976 0.89 DNM1 (0.42) TSHRALDH1A1CPB2NFKB1GSR
SCHEMBL6899876 0.89 DNM1 (0.42) TSHRALDH1A1CPB2NFKB1GSR
SCHEMBL6903115 0.89 DNM1 (0.42) TSHRALDH1A1CPB2NFKB1GSR
SCHEMBL5463098 0.86 LMNA (0.52) TSHRALDH1A1DNM1LMNACYP3A4
SCHEMBL717135 0.84 NFKB1 (0.46) TSHRALDH1A1CPB2NFKB1GSR
SCHEMBL63396 0.81 ALDH1A1 (0.44) TSHRALDH1A1THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0858437-B1 ECOLOGICALLY COMPATIBLE WATER-BASED MULLITE SOLS, MULLITE COMPOSITIONS AND METHODS OF MAKING THE SAME SIEMENS WESTINGHOUSE POWER (US) 1999-12-01 EP claimed
US-5932168-A Methods for making ecologically compatible water-based mullite sols and mullite compositions SIEMENS WESTINGHOUSE POWER CORPORATION (US) 1999-08-03 US claimed
EP-0858437-A1 ECOLOGICALLY COMPATIBLE WATER-BASED MULLITE SOLS, MULLITE COMPOSITIONS AND METHODS OF MAKING THE SAME WESTINGHOUSE ELECTRIC CORPORATION (US) 1998-08-19 EP claimed
WO-1997016393-A1 ECOLOGICALLY COMPATIBLE WATER-BASED MULLITE SOLS, MULLITE COMPOSITIONS AND METHODS OF MAKING THE SAME WESTINGHOUSE ELECTRIC CORPORATION (US) 1997-05-09 WO claimed
JP-61204223-A None JP disclosed
EP-4356737-A2 BIOCIDE Purgos ApS (DK) 2024-04-24 EP disclosed
WO-2023227179-A1 IMPROVED BIOCIDE PURGOS APS (DK) 2023-11-30 WO disclosed
EP-4282269-A1 IMPROVED BIOCIDE Purgos ApS (DK) 2023-11-29 EP disclosed
EP-4247164-A1 BIOCIDE Purgos ApS (DK) 2023-09-27 EP disclosed
WO-2022105978-A1 Biocide PURGOS APS (DK) 2022-05-27 WO disclosed
EP-4000399-A1 BIOCIDE Purgos ApS (DK) 2022-05-25 EP disclosed
US-20100267596-A1 METHOD FOR IMPROVING THE HYDROLYSIS STABILITY OF IONIC LIQUIDS BASE SE (DE) 2010-10-21 US disclosed
US-4703100-A Process for the production of polyisocyanates containing urea and/or biuret groups, preparations obtainable thereby and their use BAYER AKTIENGESELLSCHAFT (DE) 1987-10-27 US disclosed
US-4677136-A MOLDING MATERIALS BAYER AKTIENGESELLSCHAFT (DE) 1987-06-30 US disclosed
US-4658065-A USING A HETEROPOLY ACID CATALYSTS TO COPOLYMERIZE REUSEABLE RANDOMLY TETRAHYDROFURAN AND A POLYOL ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1987-04-14 US disclosed
JP-S61204223-A PRODUCTION OF NITROGEN-CONTAINING POLYALKYLENE ETHER POLYOL AND NOVEL POLYETHER GLYCOL ASAHI CHEM IND CO LTD 1986-09-10 JP disclosed
EP-0158229-A1 Process for producing polyether polyol, the produced polyether polyol and polyurethane Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1985-10-16 EP disclosed
US-4500656-A CONTAINING LIQUID ADDUT OF AMINE AND CARBON DIOXIDE BAYER AKTIENGESELLSCHAFT (DE) 1985-02-19 US disclosed
US-4469856-A Non-crystalline polyamine/carbonic acid salt compositions, a process for their preparation and their use for the production of polyurethane ureas, especially foamed coatings BAYER AKTIENGESELLSCHAFT (DE) 1984-09-04 US disclosed
US-4060549-A Process for preparing sulfonic acid fluorides BAYER AKTIENGESELLSCHAFT (DT) 1977-11-29 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 (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-20100267596-A1 METHOD FOR IMPROVING THE HYDROLYSIS STABILITY OF IONIC LIQUIDS LIPA, IDE, CEL TSHR 3700/4885ALDH1A1 997/4885CPB2 1089/4885

“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.