SCHEMBL17320591

SCHEMBL17320591

CCCCOC(OCCCC)c1ccco1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.42
MEN1 O00255 3/20 0.42
ALDH1A1 P00352 4/20 0.41
HTT P42858 1/20 0.41
MAPT P10636 6/20 0.40
HPGD P15428 4/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
POLB P06746 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
TSHR P16473 4/20 0.39
KDM4E B2RXH2 3/20 0.39
NPC1 O15118 2/20 0.39
TP53 P04637 2/20 0.39
RAB9A P51151 2/20 0.39
HSD17B10 Q99714 2/20 0.39
LMNA P02545 1/20 0.38
HDAC3 O15379 1/20 0.37
CASP3 P42574 1/20 0.36

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
SCHEMBL27996379 0.90 KMT2A (0.41) KMT2AMEN1ALDH1A1HTTMAPT
SCHEMBL15384175 0.85 KMT2A (0.39) KMT2AMEN1ALDH1A1HTTMAPT
SCHEMBL574423 0.80 L3MBTL1 (0.39) KMT2AMEN1ALDH1A1HTTMAPT
SCHEMBL17262628 0.79 ATM (0.37) KMT2AMEN1ALDH1A1HTTMAPT
SCHEMBL15384208 0.79 LMNA (0.35) KMT2AMEN1ALDH1A1HTTHPGD
SCHEMBL11007869 0.79 ALDH1A1 (0.39) KMT2AMEN1ALDH1A1HTTMAPT
SCHEMBL23578461 0.78 KMT2A (0.35) KMT2AMEN1ALDH1A1HTTMAPT
SCHEMBL5414452 0.74 KMT2A (0.49) KMT2AMEN1ALDH1A1MAPTHPGD
SCHEMBL29023776 0.73 L3MBTL1 (0.38) KMT2AMEN1ALDH1A1HTTMAPT
SCHEMBL17320594 0.71 ALDH1A1 (0.40) KMT2AMEN1ALDH1A1HTTMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106957289-B A kind of method that one kettle way situ catalytic carbohydrate prepares furans ethers 厦门大学 2019-11-08 CN disclosed
CN-106957289-A A kind of method that one kettle way situ catalytic carbohydrate prepares furans ethers 厦门大学 2017-07-18 CN disclosed
CN-104402722-B A kind of method that levulinate and furan derivatives are prepared in lignocellulose-like biomass alcoholysis 中国科学院广州能源研究所 2016-06-08 CN disclosed
US-20150353518-A1 CATALYST AND CATALYTIC PROCESS FOR THE ETHERIFICATION/REDUCTION OF FURFURYL DERIVATIVES TO TETRAHYDROFURFURYL ETHERS UNIVERSITAT POLITECNICA DE VALENCIA (ES) 2015-12-10 US disclosed
US-20150353518-A1 CATALYST AND CATALYTIC PROCESS FOR THE ETHERIFICATION/REDUCTION OF FURFURYL DERIVATIVES TO TETRAHYDROFURFURYL ETHERS UNIVERSITAT POLITECNICA DE VALENCIA (ES) 2015-12-10 US disclosed
CN-104402722-A Lignocellulose biomass alcoholysis method for preparation of levulinate and furan derivative GUANGZHOU INST ENERGY CONV CAS 2015-03-11 CN 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-20150353518-A1 CATALYST AND CATALYTIC PROCESS FOR THE ETHERIFICATION/REDUCTION OF FURFURYL DERIVATIVES TO TETRAHYDROFURFURYL ETHERS ADH1A, ADH1C, ADH5 KMT2A 356/4885MEN1 1678/4885ALDH1A1 134/4885

“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.