SCHEMBL2111572

SCHEMBL2111572

OC(COC(c1ccccc1)(c1ccccc1)c1ccccc1)COC(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.50
TK1 P04183 2/20 0.49
CTSK P43235 3/20 0.47
DUT P33316 1/20 0.40
ALOX15 P16050 2/20 0.40
CYP2C9 P11712 1/20 0.40
TSHR P16473 1/20 0.40
CYP2C19 P33261 1/20 0.40
CA1 P00915 3/20 0.39
CASR P41180 1/20 0.37
LMNA P02545 2/20 0.36
CA2 P00918 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
CYP2D6 P10635 1/20 0.36
HRH4 Q9H3N8 1/20 0.36
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
GRIN1 Q05586 1/20 0.35
GRIN2A Q12879 1/20 0.35

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
SCHEMBL15827068 0.91 MAPT (0.49) KIF11TK1CTSKDUTALOX15
SCHEMBL6522822 0.90 TK1 (0.46) KIF11TK1CTSKDUTALOX15
SCHEMBL465454 0.90 TK1 (0.46) KIF11TK1CTSKDUTALOX15
SCHEMBL14168221 0.88 KIF11 (0.53) KIF11TK1CTSKDUTALOX15
SCHEMBL9613450 0.88 TK1 (0.45) KIF11TK1CTSKDUTALOX15
SCHEMBL4917240 0.88 KIF11 (0.53) KIF11TK1CTSKDUTALOX15
SCHEMBL4771137 0.88 TK1 (0.48) KIF11TK1CTSKDUTALOX15
SCHEMBL21087595 0.88 TK1 (0.48) KIF11TK1CTSKDUTALOX15
SCHEMBL10772460 0.87 TK1 (0.54) KIF11TK1CTSKDUTALOX15
SCHEMBL16281907 0.87 KIF11 (0.50) KIF11TK1CTSKDUTALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117186145-B Preparation method of glyceraldehyde-3-phosphoric acid 长沙晨辰医药科技有限公司 2024-05-28 CN claimed
CN-117186145-A Preparation method of glyceraldehyde-3-phosphoric acid 长沙晨辰医药科技有限公司 2023-12-08 CN claimed
EP-0036155-A2 Polymerisable phospholipids, process for their preparation, polymeric phospholipids, process for their preparation as well as the use of the polymeric phospholipids Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 1981-09-23 EP claimed
CN-117186145-B Preparation method of glyceraldehyde-3-phosphoric acid 长沙晨辰医药科技有限公司 2024-05-28 CN disclosed
CN-117186145-A Preparation method of glyceraldehyde-3-phosphoric acid 长沙晨辰医药科技有限公司 2023-12-08 CN disclosed
US-9907854-B2 Crosslinking reagents, macromolecules, therapeutic bioconjugates, and synthetic methods thereof CellMosaic, Inc. (US) 2018-03-06 US disclosed
WO-2017090007-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF UREA CYCLE DISORDERS AND HEPATIC DISEASES RAO M SURYA (IN) 2017-06-01 WO disclosed
WO-2017090007-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF UREA CYCLE DISORDERS AND HEPATIC DISEASES RAO M SURYA (IN) 2017-06-01 WO disclosed
US-20170065726-A1 NOVEL CROSSLINKING REAGENTS, MACROMOLECULES, THERAPEUTIC BIOCONJUGATES, AND SYNTHETIC METHODS THEREOF CELLMOSAIC INC (US) 2017-03-09 US disclosed
US-9511150-B2 Crosslinking reagents, macromolecules, therapeutic bioconjugates, and synthetic methods thereof CellMosaic, Inc. (US) 2016-12-06 US disclosed
US-8907079-B2 Crosslinking reagents, macromolecules, therapeutic conjugates, and synthetic methods thereof CELLMOSAIC INC. (US) 2014-12-09 US disclosed
US-20090156801-A1 BIOMOLECULE LABELING REACTANTS BASED ON AZACYCLOALKANES AND CONJUGATES DERIVED THEREOF NXP B.V. (NL) 2009-06-18 US disclosed
EP-2016060-A1 BIOMOLECULE LABELING REACTANTS BASED ON AZACYCLOALKANES AND CONJUGATES DERIVED THEREOF Wallac OY (FI) 2009-01-21 EP disclosed
WO-2007128874-A1 BIOMOLECULE LABELING REACTANTS BASED ON AZACYCLOALKANES AND CONJUGATES DERIVED THEREOF WALLAC OY (FI) 2007-11-15 WO disclosed
US-5374646-A Treatment or prophylasix of hypertension and diseases associated with cognitive disorders GLAXO GROUP LIMITED (GB) 1994-12-20 US disclosed
EP-0434249-A2 Benzofuran derivatives GLAXO GROUP LIMITED (GB) 1991-06-26 EP disclosed
EP-0152965-B1 PROCESS FOR PREPARING 2,6-SUBSTITUTED-9-(1,3-DIHYDROXY-2-PROPOXY-MENTHYL)-PURINES AND CERTAIN DERIVATIVES SYNTEX (U.S.A.) INC. (US) 1990-10-24 EP disclosed
EP-0002062-B1 CYCLIC ORGANOPHOSPHORUS COMPOUNDS, METHOD FOR THEIR PREPARATION AND THEIR USE Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 1982-05-05 EP disclosed
EP-0036155-A2 Polymerisable phospholipids, process for their preparation, polymeric phospholipids, process for their preparation as well as the use of the polymeric phospholipids Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 1981-09-23 EP disclosed
EP-0002062-A1 Cyclic organophosphorus compounds, method for their preparation and their use Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 1979-05-30 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 (2 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-20170065726-A1 NOVEL CROSSLINKING REAGENTS, MACROMOLECULES, THERAPEUTIC BIOCONJUGATES, AND SYNTHETIC METHODS THEREOF CD44, ADH1C, EPCAM KIF11 370/4885TK1 1899/4885CTSK 3954/4885
US-20090156801-A1 BIOMOLECULE LABELING REACTANTS BASED ON AZACYCLOALKANES AND CONJUGATES DERIVED THEREOF DNMT1, PTMS, DNMT3A KIF11 2393/4885TK1 11/4885CTSK 36/4885

“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.