SCHEMBL4444465

SCHEMBL4444465

CC(=O)Oc1ccc(OC(C)=O)c2ccccc12

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.61
SLC22A6 Q4U2R8 1/20 0.58
KDM4E B2RXH2 6/20 0.55
TSHR P16473 5/20 0.55
ALDH1A1 P00352 3/20 0.55
HSD17B10 Q99714 3/20 0.55
TDP1 Q9NUW8 2/20 0.55
ESR1 P03372 1/20 0.55
ITGB3 P05106 1/20 0.55
ITGA2B P08514 1/20 0.55
HMGB1 P09429 1/20 0.55
HPGD P15428 1/20 0.55
GGT1 P19440 1/20 0.55
PTGS1 P23219 1/20 0.55
PTGS2 P35354 1/20 0.55
BLM P54132 1/20 0.55
NAPRT Q6XQN6 1/20 0.55
PKM P14618 2/20 0.50
RAB9A P51151 2/20 0.50
CYP3A4 P08684 1/20 0.50

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
SCHEMBL30002719 1.00 HTT (0.61) HTTSLC22A6KDM4ETSHRALDH1A1
SCHEMBL9195639 0.92 HTT (0.54) HTTSLC22A6KDM4ETSHRALDH1A1
SCHEMBL6688920 0.91 HTT (0.56) HTTSLC22A6KDM4ETSHRALDH1A1
SCHEMBL26022648 0.90 HTT (0.62) HTTSLC22A6KDM4ETSHRALDH1A1
SCHEMBL27842430 0.90 ESR1 (0.53) HTTSLC22A6KDM4ETSHRALDH1A1
SCHEMBL484956 0.88 HTT (0.51) HTTSLC22A6KDM4ETSHRALDH1A1
SCHEMBL11750981 0.88 TSHR (0.68) HTTSLC22A6KDM4ETSHRALDH1A1
SCHEMBL29058999 0.88 PKM (0.68) HTTSLC22A6KDM4ETSHRALDH1A1
SCHEMBL7861078 0.87 KDM4E (0.53) HTTSLC22A6KDM4ETSHRALDH1A1
SCHEMBL11550091 0.87 KDM4E (0.62) HTTSLC22A6KDM4ETSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4892912-A DEPOLYMERIZATION THEN POLYMERIZING FRAGMENTS, ELASTICITY, MECHANICAL STRENGTH IDEMITSU PETROCHEMICAL CO., LTD. (JP) 1990-01-09 US claimed
US-11613509-B2 Radical polymerization control agent and radical polymerization control method KAWASAKI KASEI CHEMICALS LTD. (JP) 2023-03-28 US disclosed
WO-2021125905-A1 NOVEL THIAZOLE DERIVATIVE AND USE THEREOF 가천대학교 산학협력단 2021-06-24 WO disclosed
US-20210122692-A1 RADICAL POLYMERIZATION CONTROL AGENT AND RADICAL POLYMERIZATION CONTROL METHOD KAWASAKI KASEI CHEMICALS LTD. (JP) 2021-04-29 US disclosed
CN-102816308-B Preparation method of thermotropic liquid crystal polyarylate UNIV DONGHUA 2014-06-18 CN disclosed
CN-102816308-A Preparation method of thermotropic liquid crystal polyarylate UNIV DONGHUA 2012-12-12 CN disclosed
EP-0982621-B1 Film for optical elements NIPPON MITSUBISHI OIL CORP (JP) 2012-10-10 EP disclosed
EP-2136845-A2 CONTROLLED RELEASE SYSTEM The Nottingham Trent University (GB) 2009-12-30 EP disclosed
WO-2008110813-A2 CONTROLLED RELEASE SYSTEM THE NOTTINGHAM TRENT UNIVERSITY (GB) 2008-09-18 WO disclosed
WO-2008110813-A2 CONTROLLED RELEASE SYSTEM THE NOTTINGHAM TRENT UNIVERSITY (GB) 2008-09-18 WO disclosed
EP-0982621-A2 Film for optical elements Nippon Mitsubishi Oil Corporation (JP) 2000-03-01 EP disclosed
EP-0321691-B1 PROCESS FOR PRODUCING AROMATIC POLYESTER IDEMITSU PETROCHEMICAL CO. LTD. (JP) 1993-09-29 EP disclosed
US-4892912-A DEPOLYMERIZATION THEN POLYMERIZING FRAGMENTS, ELASTICITY, MECHANICAL STRENGTH IDEMITSU PETROCHEMICAL CO., LTD. (JP) 1990-01-09 US disclosed
EP-0321691-A2 Process for producing aromatic polyester IDEMITSU PETROCHEMICAL CO. LTD. (JP) 1989-06-28 EP disclosed
US-4542203-A Method for producing branched aromatic polyesters SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1985-09-17 US 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-11613509-B2 Radical polymerization control agent and radical polymerization control method PPOX, NOX4, CROCC HTT 1452/4885SLC22A6 4844/4885KDM4E 1028/4885
US-20210122692-A1 RADICAL POLYMERIZATION CONTROL AGENT AND RADICAL POLYMERIZATION CONTROL METHOD PPOX, NOX4, CROCC HTT 1452/4885SLC22A6 4844/4885KDM4E 1028/4885

“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.