Phenol

Phenol

SCHEMBL21995529

N#Cc1ccccc1C#N.Oc1ccccc1.Oc1ccccc1

nearest known ligand 0.59

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 1/20 0.59
CA2 P00918 3/20 0.58
CA12 O43570 2/20 0.58
CA3 P07451 2/20 0.58
CA9 Q16790 2/20 0.58
CA14 Q9ULX7 2/20 0.58
CA1 P00915 2/20 0.58
GLA P06280 1/20 0.58
CA4 P22748 1/20 0.58
TDP1 Q9NUW8 1/20 0.58
TSHR P16473 3/20 0.48
CA6 P23280 1/20 0.46
CYP19A1 P11511 1/20 0.42
MAOB P27338 3/20 0.42
MAOA P21397 2/20 0.42
MMP3 P08254 2/20 0.42
BCL2L1 Q07817 1/20 0.42
MCL1 Q07820 1/20 0.41
KDM4E B2RXH2 3/20 0.41
GAA P10253 2/20 0.41

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
Phenol SCHEMBL28984274 1.00 ESR2 (0.59) ESR2CA2CA12CA3CA9
Phenol SCHEMBL28712610 1.00 ESR2 (0.59) ESR2CA2CA12CA3CA9
Phenol SCHEMBL4055493 0.88 ESR2 (0.53) ESR2CA2CA12CA3CA9
Benzene SCHEMBL27565604 0.86 TSHR (0.60) ESR2CA2CA1TSHRMAOB
Resorcinol SCHEMBL15137008 0.85 CYP3A4 (0.57) ESR2CA2CA12CA9CA14
Resorcinol SCHEMBL17818516 0.85 CYP3A4 (0.57) ESR2CA2CA12CA9CA14
Phenol SCHEMBL19411862 0.84 ESR2 (0.46) ESR2CA2CA12CA3CA9
Phenol SCHEMBL10563897 0.83 CA12 (0.73) ESR2CA2CA12CA3CA9
Phenol SCHEMBL28018574 0.83 CA12 (0.73) ESR2CA2CA12CA3CA9
SCHEMBL2818597 0.83 TSHR (0.63) ESR2CA2CA1TSHRMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117659407-A Preparation method of bisphthalonitrile resin co-mixed silicon resin 哈尔滨工业大学 2024-03-08 CN claimed
CN-117586626-A High-temperature-resistant carbon fiber reinforced resin-based impact-resistant composite board and preparation method thereof 中国人民解放军军事科学院国防工程研究院 2024-02-23 CN claimed
CN-118239873-A Di-phthalonitrile monomer, resin and preparation method thereof 大连理工大学 2024-06-25 CN disclosed
US-11932750-B2 Resin blends including phthalonitrile resin and thiadiazole substituted phthalonitrile compound, articles, compounds, and methods 3M INNOVATIVE PROPERTIES COMPANY (US) 2024-03-19 US disclosed
CN-117659407-A Preparation method of bisphthalonitrile resin co-mixed silicon resin 哈尔滨工业大学 2024-03-08 CN disclosed
CN-117659407-A Preparation method of bisphthalonitrile resin co-mixed silicon resin 哈尔滨工业大学 2024-03-08 CN disclosed
CN-115368276-B Novel bisphthalonitrile compound and application thereof 北京化工大学 2024-02-02 CN disclosed
CN-114634698-B Poly (arylene ether nitrile) composite material and preparation method and application thereof 电子科技大学 2023-05-02 CN disclosed
US-20210340355-A1 Resin Blends Including Phthalonitrile Resin and Thiadiazole Substituted Phthalonitrile Compound, Articles, Compounds, and Methods 3M INNOVATIVE PROPERTIES COMPANY 2021-11-04 US disclosed
EP-3887428-A1 RESIN BLENDS INCLUDING PHTHALONITRILE RESIN AND THIADIAZOLE SUBSTITUTED PHTHALONITRILE COMPOUND, ARTICLES, COMPOUNDS, AND METHODS 3M Innovative Properties Company (US) 2021-10-06 EP disclosed
CN-113166408-A Resin blends, articles, compounds, and methods comprising phthalonitrile resins and thiadiazole-substituted phthalonitrile compounds 3M创新有限公司 2021-07-23 CN disclosed
WO-2020109902-A1 RESIN BLENDS INCLUDING PHTHALONITRILE RESIN AND THIADIAZOLE SUBSTITUTED PHTHALONITRILE COMPOUND, ARTICLES, COMPOUNDS, AND METHODS 3M INNOVATIVE PROPERTIES COMPANY (US) 2020-06-04 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-11932750-B2 Resin blends including phthalonitrile resin and thiadiazole substituted phthalonitrile compound, articles, compounds, and methods THUMPD1, RBBP5, RB1 ESR2 4210/4885CA2 4764/4885CA12 4741/4885
US-20210340355-A1 Resin Blends Including Phthalonitrile Resin and Thiadiazole Substituted Phthalonitrile Compound, Articles, Compounds, and Methods THUMPD1, RBBP5, RB1 ESR2 4210/4885CA2 4764/4885CA12 4741/4885

“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.