SCHEMBL516010

SCHEMBL516010

Cc1ccc(C)c(OCCO)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.64
TDP1 Q9NUW8 3/20 0.55
CYP2C9 P11712 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
PPARA Q07869 2/20 0.55
TTR P02766 1/20 0.55
CYP1A2 P05177 1/20 0.55
CYP2C8 P10632 1/20 0.55
CHRM1 P11229 1/20 0.55
ADRA1A P35348 1/20 0.55
PPARG P37231 1/20 0.55
HTR2B P41595 1/20 0.55
SLCO1B3 Q9NPD5 1/20 0.55
CISD1 Q9NZ45 1/20 0.55
SLCO1B1 Q9Y6L6 1/20 0.55
HTT P42858 2/20 0.51
LMNA P02545 1/20 0.51
POLB P06746 1/20 0.50
CTDSP1 Q9GZU7 1/20 0.50
KDM4E B2RXH2 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
SCHEMBL8302732 0.90 TSHR (0.67) TSHRTDP1CYP2C9SMN1; SMN2PPARA
SCHEMBL10111043 0.89 TSHR (0.57) TSHRTDP1CYP2C9SMN1; SMN2PPARA
SCHEMBL15871994 0.89 TSHR (0.65) TSHRTDP1CYP2C9SMN1; SMN2PPARA
SCHEMBL5929495 0.87 TSHR (0.67) TSHRTDP1CYP2C9SMN1; SMN2PPARA
SCHEMBL9596753 0.86 L3MBTL1 (0.51) TSHRTDP1CYP2C9SMN1; SMN2CYP1A2
SCHEMBL5266458 0.85 TSHR (0.70) TSHRTDP1CYP2C9SMN1; SMN2PPARA
SCHEMBL7056362 0.84 L3MBTL1 (0.55) TSHRSMN1; SMN2HTTKDM4EALDH1A1
SCHEMBL17124807 0.84 TSHR (0.59) TSHRTDP1CYP2C9SMN1; SMN2PPARA
SCHEMBL2092305 0.83 TSHR (0.58) TSHRTDP1CYP2C9SMN1; SMN2PPARA
SCHEMBL172302 0.82 TSHR (0.61) TSHRTDP1CYP2C9SMN1; SMN2PPARA

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 37 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108546245-A A kind of preparation method of antiproliferative activity intermediate ML-098 绍兴文理学院 2018-09-18 CN claimed
CN-111465589-B Compound having fluorene skeleton and method for producing same 帝人株式会社 2024-01-05 CN disclosed
US-11538992-B2 Formulation of an organic functional material MERCK PATENT GMBH (DE) 2022-12-27 US disclosed
US-11339249-B2 Compound having fluorene skeleton, and method for manufacturing same TEIJIN LIMITED (JP) 2022-05-24 US disclosed
EP-3747856-A1 COMPOUND HAVING FLUORENE SKELETON, AND METHOD FOR MANUFACTURING SAME Teijin Limited (JP) 2020-12-09 EP disclosed
US-20200354517-A1 COMPOUND HAVING FLUORENE SKELETON, AND METHOD FOR MANUFACTURING SAME TEIJIN LIMITED (JP) 2020-11-12 US disclosed
CN-111465589-A Compound having fluorene skeleton and method for producing same 帝人株式会社 2020-07-28 CN disclosed
WO-2020085222-A1 CRYSTAL OF COMPOUND HAVING FLUORENE SKELETON AND METHOD FOR PRODUCING SAME 帝人株式会社 2020-04-30 WO disclosed
US-20200127203-A1 FORMULATION OF AN ORGANIC FUNCTIONAL MATERIAL MERCK PATENT GMBH (DE) 2020-04-23 US disclosed
WO-2019151264-A1 COMPOUND HAVING FLUORENE SKELETON, AND METHOD FOR MANUFACTURING SAME 帝人株式会社 2019-08-08 WO disclosed
US-6465467-B1 DISEASES RELATED TO THE 5-HT2C RECEPTOR, ESPECIALLY EATING, MEMORY, MOOD, URINARY AND ANXIETY DISORDERS, SCHIZOPHRENIA, PAIN, SEXUAL DYSFUNCTIONS BIOVITRUM AB (SE) 2002-10-15 US disclosed
EP-1178973-A2 NOVEL COMPOUNDS, THEIR USE AND PREPARATION Pharmacia AB (SE) 2002-02-13 EP disclosed
WO-2000076984-A2 NOVEL COMPOUNDS, THEIR USE AND PREPARATION BIOVITRUM AB (SE) 2000-12-21 WO disclosed
EP-0391942-A1 PROCESS FOR THE PREPARATION OF ARYLOXYACETIC ACID EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1990-10-17 EP disclosed
US-4935540-A OXIDIZING ARYLOXYETHANOL IN PRESENCE OF PALLADIUM AND THALLIU M ON CARBON CATALYST, ACIDIFYING EASTMAN CHEMICAL COMPANY 1990-06-19 US disclosed
WO-1989003378-A1 PROCESS FOR THE PREPARATION OF ARYLOXYACETIC ACID EASTMAN KODAK COMPANY (US) 1989-04-20 WO disclosed
US-4804777-A OXIDATION OF ARYLOXYETHANOL USING PALLADIUM, SILVER, CARBON CATALYST EASTMAN KODAK COMPANY (US) 1989-02-14 US disclosed
EP-0011793-B1 PROCESS FOR PREPARING ARYLOXYACETIC ACIDS BAYER AG (DE) 1981-09-02 EP disclosed
US-4238625-A ACTIVATORS OF LEAD AND/OR BISMUTH AND/OR THEIR COMPOUNDS FOR OXIDATION WITH PLATINUM OR PALLADIUM CATALYST BAYER AKTIENGESELLSCHAFT (DE) 1980-12-09 US disclosed
EP-0011793-A1 Process for preparing aryloxyacetic acids BAYER AG (DE) 1980-06-11 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-20200354517-A1 COMPOUND HAVING FLUORENE SKELETON, AND METHOD FOR MANUFACTURING SAME RFT1, AFF1, RER1 TSHR 2403/4885TDP1 3407/4885CYP2C9 2841/4885
US-11339249-B2 Compound having fluorene skeleton, and method for manufacturing same RFT1, AFF1, RER1 TSHR 2403/4885TDP1 3407/4885CYP2C9 2841/4885

“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.