SCHEMBL4488320

SCHEMBL4488320

CCCCCCCCCC[CH]OCC(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BLM P54132 3/20 0.41
HSD17B10 Q99714 3/20 0.41
GMNN O75496 2/20 0.41
USP2 O75604 2/20 0.41
CYP1A2 P05177 2/20 0.41
POLB P06746 2/20 0.41
CYP2C9 P11712 2/20 0.41
APEX1 P27695 2/20 0.41
CYP2C19 P33261 2/20 0.41
RECQL P46063 2/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
TERT O14746 3/20 0.39
PTPN1 P18031 3/20 0.39
PPARG P37231 3/20 0.39
PPARD Q03181 3/20 0.39
PPARA Q07869 3/20 0.39
TOP1 P11387 3/20 0.39
MAPT P10636 2/20 0.39
FABP4 P15090 2/20 0.39

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
SCHEMBL4491454 1.00 BLM (0.41) BLMHSD17B10GMNNUSP2CYP1A2
SCHEMBL4499319 1.00 BLM (0.41) BLMHSD17B10GMNNUSP2CYP1A2
SCHEMBL4506306 1.00 BLM (0.41) BLMHSD17B10GMNNUSP2CYP1A2
SCHEMBL4483153 1.00 BLM (0.41) BLMHSD17B10GMNNUSP2CYP1A2
SCHEMBL4491770 1.00 BLM (0.41) BLMHSD17B10GMNNUSP2CYP1A2
SCHEMBL4500168 0.98 BLM (0.38) BLMHSD17B10GMNNUSP2CYP1A2
SCHEMBL4502756 0.91 TSHR (0.35) BLMHSD17B10GMNNUSP2CYP1A2
SCHEMBL4508242 0.81
SCHEMBL128962 0.78 FAAH (0.35) BLMHSD17B10GMNNUSP2CYP1A2
SCHEMBL199607 0.77 TSHR (0.46) BLMHSD17B10GMNNUSP2CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1655291-B1 COMPOUNDS HAVING THROMBOPOIETIN RECEPTOR AGONISM SHIONOGI & CO (JP) 2016-08-03 EP disclosed
US-20090318513-A1 COMPOUNDS EXHIBITING THROMBOPOIETIN RECEPTOR AGONISM SHIONOGI & CO., LTD. 2009-12-24 US disclosed
US-7601746-B2 Compounds exhibiting thrombopoietin receptor agonism SHIONOGI & CO., LTD. (JP) 2009-10-13 US disclosed
US-20070043087-A1 Such as 3-{2,6-difluoro-4-[4,5-dihydro-6-(3,3-dimethylbutyl)naphtho[1,2-d]thiazol-2-ylcabamoyl)phenyl]-2-methylacrylic acid EDDINGPHARM (HONG KONG) COMPANY LIMITED (CN) 2007-02-22 US disclosed
EP-1655291-A1 COMPOUNDS HAVING THROMBOPOIETIN RECEPTOR AGONISM SHIONOGI & CO., LTD. (JP) 2006-05-10 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-20090318513-A1 COMPOUNDS EXHIBITING THROMBOPOIETIN RECEPTOR AGONISM MPL, TEK, GHRHR BLM 4519/4885HSD17B10 2963/4885GMNN 3766/4885
US-20070043087-A1 Such as 3-{2,6-difluoro-4-[4,5-dihydro-6-(3,3-dimethylbutyl)naphtho[1,2-d]thiazol-2-ylcabamoyl)phenyl]-2-methylacrylic acid DHFR, NAT1, ACR BLM 2561/4885HSD17B10 393/4885GMNN 2052/4885

“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.