SCHEMBL9965243

SCHEMBL9965243

CC(C)(C)OCCC(C)(C)OS(C)(=O)=O

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
USP2 O75604 2/20 0.32
TSHR P16473 2/20 0.32
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
MMP9 P14780 1/20 0.31
ALOX15 P16050 1/20 0.31

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
SCHEMBL9965242 0.83 ALDH1A1 (0.31) TSHRALDH1A1
SCHEMBL18231628 0.81
SCHEMBL14527794 0.80 KDM4E (0.31) USP2TSHRKDM4EALDH1A1LMNA
SCHEMBL19322614 0.77
SCHEMBL23431353 0.77
SCHEMBL19257180 0.74 KDM4E (0.41) USP2TSHRKDM4EALDH1A1LMNA
SCHEMBL783198 0.72 USP2 (0.56) USP2TSHRKDM4EALDH1A1LMNA
SCHEMBL22892502 0.71 NR3C2 (0.33)
SCHEMBL881573 0.70 ALDH1A1 (0.39) KDM4EALDH1A1LMNA
SCHEMBL3694219 0.70 USP2 (0.52) USP2TSHRKDM4EALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3406614-B1 OPIOID RECEPTOR ANTAGONIST CONJUGATE AND USE THEREOF SHANGHAI HANMAI BIO PHARMA CO LTD (CN) 2022-12-28 EP disclosed
US-20150174264-A1 Oligomer-Antihistamine Conjugates NEKTAR THERAPEUTICS (US) 2015-06-25 US disclosed
US-8895068-B2 Nanoparticle composition and associated methods thereof GENERAL ELECTRIC COMPANY (US) 2014-11-25 US disclosed
US-8889103-B2 Diagnostic agent composition and associated methods thereof GENERAL ELECTRIC COMPANY (US) 2014-11-18 US disclosed
US-8269021-B2 Aromatic imide-based dispersant for carbon nanotubes and carbon nanotube composition comprising the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2012-09-18 US disclosed
US-20120156141-A1 NANOPARTICLE COMPOSITION AND ASSOCIATED METHODS THEREOF GENERAL ELECTRIC COMPANY (US) 2012-06-21 US disclosed
WO-2012080290-A1 NANOPARTICLE COMPOSITION AND ASSOCIATED METHODS THEREOF GENERAL ELECTRIC COMPANY (US) 2012-06-21 WO disclosed
US-20110227002-A1 AROMATIC IMIDE-BASED DISPERSANT FOR CARBON NANOTUBES AND CARBON NANOTUBE COMPOSITION COMPRISING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2011-09-22 US disclosed
US-20100184989-A1 De Novo Synthesis of Conjugates NEKTAR THERAPEUTICS (US) 2010-07-22 US disclosed
WO-2008112261-A1 OLIGOMER-ANTICHOLINERGIC AGENT CONJUGATES NEKTAR THERAPEUTICS AL, CORPORATION (US) 2008-09-18 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 (4 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-20150174264-A1 Oligomer-Antihistamine Conjugates HRH4, HRH1, HRH3 USP2 572/4885TSHR 3564/4885KDM4E 3217/4885
US-20100184989-A1 De Novo Synthesis of Conjugates ABCG2, UGT1A8, SLC7A5 USP2 2222/4885TSHR 3018/4885KDM4E 4261/4885
US-20110227002-A1 AROMATIC IMIDE-BASED DISPERSANT FOR CARBON NANOTUBES AND CARBON NANOTUBE COMPOSITION COMPRISING THE SAME EWSR1, NES, CENPE USP2 1915/4885TSHR 4383/4885KDM4E 1526/4885
US-20120156141-A1 NANOPARTICLE COMPOSITION AND ASSOCIATED METHODS THEREOF PHOSPHO1, PIK3CA, PTEN USP2 2226/4885TSHR 3625/4885KDM4E 3038/4885

“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.