SCHEMBL21858484

SCHEMBL21858484

OCOc1ccc2cc(-c3ccccc3)ccc2c1-c1c(OCO)ccc2cc(-c3ccccc3)ccc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 4/20 0.51
ESR2 Q92731 4/20 0.51
GPR84 Q9NQS5 3/20 0.47
HSD17B1 P14061 7/20 0.47
HSD17B2 P37059 7/20 0.47
CYP1A2 P05177 4/20 0.47
CYP3A4 P08684 4/20 0.47
CYP2C9 P11712 4/20 0.47
CYP2C19 P33261 4/20 0.47
CYP2D6 P10635 3/20 0.47
CYP2B6 P20813 3/20 0.47
ALOX5 P09917 1/20 0.42
MAP4K4 O95819 1/20 0.40
TYK2 P29597 1/20 0.40
MINK1 Q8N4C8 1/20 0.40
SRPK1 Q96SB4 1/20 0.40
CLK4 Q9HAZ1 1/20 0.40
SLC6A9 P48067 1/20 0.37
CYP11B1 P15538 1/20 0.37
CYP11B2 P19099 1/20 0.37

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
SCHEMBL29895961 0.89 ESR1 (0.50) ESR1ESR2GPR84HSD17B1HSD17B2
SCHEMBL29506872 0.89 ESR1 (0.50) ESR1ESR2GPR84HSD17B1HSD17B2
SCHEMBL20774057 0.89 ESR1 (0.50) ESR1ESR2GPR84HSD17B1HSD17B2
SCHEMBL28390461 0.89 HSD17B1 (0.45) ESR1ESR2GPR84HSD17B1HSD17B2
SCHEMBL26582588 0.87 ESR1 (0.48) ESR1ESR2GPR84HSD17B1HSD17B2
SCHEMBL31443100 0.84 ALOX5 (0.46) ESR1ESR2GPR84HSD17B1HSD17B2
SCHEMBL26582598 0.84 MAPT (0.45) ESR1ESR2GPR84HSD17B1HSD17B2
SCHEMBL29506873 0.84 PPARD (0.52) ESR1ESR2GPR84
SCHEMBL20774095 0.84 PPARD (0.52) ESR1ESR2GPR84
SCHEMBL30634841 0.84 PPARD (0.52) ESR1ESR2GPR84

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
US-11952460-B2 Polycarbonate resin, method for producing the same, and optical lens MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2024-04-09 US disclosed
WO-2023208837-A1 OLIGOMERIC BINAPHTHYL COMPOUNDS AND THERMOPLASTIC RESINS REUTER CHEMISCHE APPARATEBAU E.K. (DE) 2023-11-02 WO disclosed
EP-4102262-A2 THERMOPLASTIC RESIN, METHOD FOR MANUFACTURING SAME, AND OPTICAL LENS Mitsubishi Gas Chemical Company, Inc. (JP) 2022-12-14 EP disclosed
US-20220145004-A1 THERMOPLASTIC RESIN, METHOD FOR MANUFACTURING SAME, AND OPTICAL LENS MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2022-05-12 US disclosed
EP-3933457-A1 THERMOPLASTIC RESIN, METHOD FOR MANUFACTURING SAME, AND OPTICAL LENS MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2022-01-05 EP disclosed
US-20210355058-A1 POLYCYCLIC COMPOUNDS MITSUBISHI GAS CHEMICAL CO (JP) 2021-11-18 US disclosed
US-20210340317-A1 POLYCYCLIC COMPOUNDS REUTER CHEMISCHE APPARATEBAU E.K. (DE) 2021-11-04 US disclosed
EP-3677615-A1 POLYCARBONATE RESIN, METHOD FOR PRODUCING SAME AND OPTICAL LENS Mitsubishi Gas Chemical Company, Inc. (JP) 2020-07-08 EP disclosed
US-20200181325-A1 POLYCARBONATE RESIN, METHOD FOR PRODUCING THE SAME, AND OPTICAL LENS MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2020-06-11 US disclosed
WO-2020079225-A1 POLYCYCLIC COMPOUNDS REUTER CHEMISCHE APPARATEBAU E.K. (DE) 2020-04-23 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-20210340317-A1 POLYCYCLIC COMPOUNDS CBR1, C1R, CBR3 ESR1 169/4885ESR2 157/4885GPR84 182/4885
US-20210355058-A1 POLYCYCLIC COMPOUNDS CBR1, CBR3, C1R ESR1 190/4885ESR2 155/4885GPR84 215/4885

“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.