SCHEMBL4892566

SCHEMBL4892566

CCCOCCCOC(=O)C=CC#N

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.52
HCAR2 Q8TDS4 4/20 0.46
HPGD P15428 1/20 0.41
TSHR P16473 1/20 0.41
MAPT P10636 1/20 0.41
RAB9A P51151 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
APP P05067 6/20 0.35
ZDHHC20 Q5W0Z9 2/20 0.35
ZDHHC2 Q9UIJ5 1/20 0.35
ALDH1A1 P00352 1/20 0.33
ALOX5 P09917 1/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL4888251 0.93 ATM (0.61) ATMHCAR2HPGDTSHRMAPT
SCHEMBL4892532 0.90 ATM (0.61) ATMHCAR2HPGDTSHRMAPT
SCHEMBL4888226 0.90 HCAR2 (0.47) ATMHCAR2HPGDTSHRMAPT
SCHEMBL4888287 0.90 HCAR2 (0.47) ATMHCAR2HPGDTSHRMAPT
SCHEMBL4888147 0.88 ATM (0.48) ATMHCAR2HPGDTSHRMAPT
SCHEMBL35576 0.87 ATM (0.56) ATMHCAR2HPGDTSHRMAPT
SCHEMBL4889702 0.87 ATM (0.56) ATMHCAR2HPGDTSHRMAPT
SCHEMBL24797 0.86 ATM (0.70) ATMHCAR2HPGDTSHRMAPT
SCHEMBL21999255 0.86 HCAR2 (0.59) ATMHCAR2HPGDTSHRMAPT
SCHEMBL167356 0.86 HCAR2 (0.59) ATMHCAR2HPGDTSHRMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113874459-A Flexible photocurable cyanoacrylate compositions 汉高知识产权控股有限责任公司 2021-12-31 CN disclosed
CN-105246872-B Cyanoacrylate compositions 汉高知识产权控股有限责任公司 2019-08-13 CN disclosed
CN-105246872-A Cyanoacrylate compositions Henkel US IP LLC 2016-01-13 CN disclosed
US-20080293872-A1 ADHESIVES, SEALANTS AND COATINGS CONTAINING GLASS PARTICLES AS A FILLER HENKEL AG & CO. KGAA (DE) 2008-11-27 US disclosed
US-20080287574-A1 ADHESIVES, SEALANTS AND COATINGS CONTAINING GLASS PARTICLES AS A FILLER HENKEL AG & CO. KGAA (DE) 2008-11-20 US disclosed
US-20060210528-A1 Therapy for tropical diseases ASPIRE BIOTECH, INC. 2006-09-21 US disclosed
US-20030143189-A1 Therapy for topical diseases ASPIRE BIOTECH, INC. 2003-07-31 US disclosed
WO-2003041686-A2 IMPROVED THERAPY FOR TOPICAL DISEASES MEDLOGIC GLOBAL LIMITED (GB) 2003-05-22 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 (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-20060210528-A1 Therapy for tropical diseases TSLP, TLR3, CUTA ATM 4347/4885HCAR2 2965/4885HPGD 1243/4885
US-20030143189-A1 Therapy for topical diseases TSLP, KRT18, CUTA ATM 4471/4885HCAR2 2700/4885HPGD 1200/4885

“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.