SCHEMBL296049

SCHEMBL296049

CC1CN(CCO)CC(C)O1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 3/20 0.55
EBP Q15125 1/20 0.55
PDK1 Q15118 1/20 0.43
KDM4E B2RXH2 6/20 0.41
HTT P42858 3/20 0.41
POLB P06746 2/20 0.41
BLM P54132 1/20 0.41
ALDH1A1 P00352 3/20 0.40
TDP1 Q9NUW8 1/20 0.40
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
LMNA P02545 1/20 0.37

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
SCHEMBL1564250 1.00 SIGMAR1 (0.55) SIGMAR1EBPPDK1KDM4EHTT
SCHEMBL12156723 0.87 SIGMAR1 (0.44) SIGMAR1EBPPDK1KDM4EHTT
SCHEMBL1469872 0.86 SIGMAR1 (0.62) SIGMAR1EBPPDK1KDM4EHTT
SCHEMBL1469874 0.86 SIGMAR1 (0.62) SIGMAR1EBPPDK1KDM4EHTT
SCHEMBL4021413 0.85 SIGMAR1 (0.66) SIGMAR1EBPPDK1KDM4EHTT
SCHEMBL9449900 0.83 SIGMAR1 (0.69) SIGMAR1EBPKDM4EHTTPOLB
SCHEMBL11131491 0.83 SIGMAR1 (0.69) SIGMAR1EBPKDM4EHTTPOLB
SCHEMBL14067375 0.80 SIGMAR1 (0.48) SIGMAR1EBPPDK1KDM4EHTT
SCHEMBL10129057 0.78 SIGMAR1 (0.69) SIGMAR1EBPPDK1KDM4EHTT
SCHEMBL10129761 0.78 SIGMAR1 (0.69) SIGMAR1EBPPDK1KDM4EHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1528925-B1 QUINAZOLINE DERIVATIVES FOR USE IN THE TREATMENT OF CANCER ASTRAZENECA AB (SE) 2009-04-22 EP claimed
US-7504408-B2 Quinzoline derivatives for use in the treatment of cancer ASTRAZENECA AB (SE) 2009-03-17 US claimed
US-20050250797-A1 Quinzoline derivatives for use in the treatment of cancer ASTRAZENECA AB (SE) 2005-11-10 US claimed
EP-1528925-A1 QUINAZOLINE DERIVATIVES FOR USE IN THE TREATMENT OF CANCER Astrazeneca AB (SE) 2005-05-11 EP claimed
WO-2004004732-A1 QUINAZOLINE DERIVATIVES FOR USE IN THE TREATMENT OF CANCER ASTRAZENECA AB (SE) 2004-01-15 WO claimed
EP-1112296-A1 HIGH GREEN STRENGTH REACTIVE HOT MELT BY A PREPOLYMERIZATION IN THE MAIN REACTOR National Starch and Chemical Investment Holding Corporation (US) 2001-07-04 EP claimed
WO-2000075209-A1 HIGH GREEN STRENGTH REACTIVE HOT MELT BY A PREPOLYMERIZATION IN THE MAIN REACTOR NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION (US) 2000-12-14 WO claimed
EP-0668302-B1 Catalyst for reactive hot melt adhesives NAT STARCH CHEM INVEST (US) 1999-12-22 EP claimed
US-4095022-A PHOSPHORUS COMPOUNDS, SILICA-ALUMINA CATALYST TEXACO DEVELOPMENT CORPORATION (US) 1978-06-13 US claimed
US-4026935-A FROM N-(HYDROXYALKYL)-MORPHOLINE COMPOUND, SILICA-ALUMINA CATALYST TEXACO DEVELOPMENT CORPORATION (US) 1977-05-31 US claimed
JP-6146028-A None JP disclosed
US-10208169-B2 Methods of modifying agricultural co-products BATTELLE MEMORIAL INSTITUTE (US) 2019-02-19 US disclosed
US-9745437-B2 Method for the preparation of microcellular polyurethane elastomers SKC CO. LTD. (KR) 2017-08-29 US disclosed
EP-2797975-B1 METHOD FOR THE PREPARATION OF MICROCELLULAR POLYURETHANE ELASTOMERS SKC CO LTD (KR) 2017-06-28 EP disclosed
US-20160319083-A1 Methods of Modifying Agricultural Co-Products and Products Made Therefrom BATTELLE MEMORIAL INSTITUTE (US) 2016-11-03 US disclosed
EP-0529973-A1 Fungicidal 2-aryl-2-cyano-2-(heterocyclylalkyl)ethyl-1,2,4-triazoles ROHM AND HAAS COMPANY (US) 1993-03-03 EP disclosed
EP-0426491-A2 Herbicidal, optically active or racemic substituted propionic acid derivatives, herbicide compositions containing them and process for preparing same ALKALOIDA VEGYESZETI GYAR (HU) 1991-05-08 EP disclosed
US-4455168-A CONTAINING A HETEROCYCLIC, HYDROXY AMINE OR AMIDE RICOH COMPANY, LTD. (JP) 1984-06-19 US disclosed
US-4095022-A PHOSPHORUS COMPOUNDS, SILICA-ALUMINA CATALYST TEXACO DEVELOPMENT CORPORATION (US) 1978-06-13 US disclosed
US-4026935-A FROM N-(HYDROXYALKYL)-MORPHOLINE COMPOUND, SILICA-ALUMINA CATALYST TEXACO DEVELOPMENT CORPORATION (US) 1977-05-31 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-20050250797-A1 Quinzoline derivatives for use in the treatment of cancer TPD52L2, NQO2, CCNI SIGMAR1 360/4885EBP 3668/4885PDK1 1791/4885

“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.