Protokylol

Protokylol

SCHEMBL210099

CC(Cc1ccc2c(c1)OCO2)NCC(O)c1ccc(O)c(O)c1.Cl

nearest known ligand 0.74

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRB2

The experimentally established mechanism targets of Protokylol. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB2 known ✓ P07550 15/20 0.74
ADRB1 P08588 14/20 0.74
ADRB3 P13945 13/20 0.74
ADRA1D P25100 10/20 0.74
ADRA1A P35348 10/20 0.74
ADRA1B P35368 10/20 0.74
KDM4E B2RXH2 2/20 0.54
MAPT P10636 2/20 0.54
TSHR P16473 2/20 0.54
MAPK1 P28482 2/20 0.54
HSD17B10 Q99714 2/20 0.54
TDP1 Q9NUW8 2/20 0.54
CASP3 P42574 1/20 0.54
CASP6 P55212 1/20 0.54
POLB P06746 1/20 0.54
GAA P10253 1/20 0.54
BLM P54132 1/20 0.54
PMP22 Q01453 1/20 0.54
RXFP1 Q9HBX9 1/20 0.54
CYP2D6 P10635 1/20 0.53

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
Protokylol SCHEMBL50567 0.99 ADRB2 (0.76) ADRB2ADRB1ADRB3ADRA1DADRA1A
Protokylol SCHEMBL523029 0.97 ADRB2 (0.73) ADRB2ADRB1ADRB3ADRA1DADRA1A
SCHEMBL11191804 0.86 ADRB2 (0.68) ADRB2ADRB1ADRB3ADRA1DADRA1A
SCHEMBL11670365 0.86 ADRB3 (0.70) ADRB2ADRB1ADRB3ADRA1DADRA1A
SCHEMBL7154315 0.84 ADRB2 (0.68) ADRB2ADRB1ADRB3ADRA1DADRA1A
SCHEMBL7154320 0.84 ADRB2 (0.68) ADRB2ADRB1ADRB3ADRA1DADRA1A
Hydrochloric Acid SCHEMBL11086014 0.82 ADRB2 (0.60) ADRB2ADRB1ADRB3ADRA1DADRA1A
Protokylol SCHEMBL3716556 0.82 ADRB2 (0.53) ADRB2ADRB1ADRB3ADRA1DADRA1A
SCHEMBL8305498 0.81 ADRB3 (0.68) ADRB2ADRB1ADRB3ADRA1DADRA1A
SCHEMBL8305494 0.81 ADRB3 (0.68) ADRB2ADRB1ADRB3ADRA1DADRA1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060258735-A1 1,3-Bis-(substituted-phenyl)-2-propen-1-ones and their use to treat VCAM-1 mediated disorders MENG CHARLES Q 2006-11-16 US claimed
EP-1330459-B1 TRIPTOLIDE ANALOGS FOR THE TREATMENT OF AUTOIMMUNE AND INFLAMMATORY DISORDERS UNIV EMORY (US) 2006-08-02 EP claimed
US-7078431-B2 1,3-bis-(substituted-phenyl)-2-propen-1-ones and their use to treat VCAM-1 mediated disorders ATHEROGENICS, INC. (US) 2006-07-18 US claimed
US-6777441-B2 FOR THERAPY AND PROPHYLAXIS EMORY UNIVERSITY 2004-08-17 US claimed
US-20030236298-A1 1,3-bis-(substituted-phenyl)-2-propen-1-ones and their use to treat VCAM-1 mediated disorders ATHEROGENICS PHARMACEUTICALS, INC. 2003-12-25 US claimed
US-6608101-B1 Inflammatory disorders; 3-(2,4-dimethoxy-5-(thien-2-yl)phenyl)-1-(4-carboxymethoxy-3,5 -dimethoxyphenyl)-2-propen-1-one; ATHEROGENICS, INC. 2003-08-19 US claimed
EP-1330448-A2 1,3-BIS-(SUBSTITUTED-PHENYL)-2-PROPEN-1-ONES AND THEIR USE TO TREAT VCAM-1 MEDIATED DISORDERS Atherogenics, Inc. (US) 2003-07-30 EP claimed
WO-2001098291-A2 1,3-BIS-(SUBSTITUTED-PHENYL)-2-PROPEN-1-ONES AND THEIR USE TO TREAT VCAM-1 MEDIATED DISORDERS ATHEROGENICS, INC. (US) 2001-12-27 WO claimed
US-20240145031-A1 Methods and devices for drug repositioning and drug repurposing as nuclear receptor modulators Precision Medicine Lab (NL) 2024-05-02 US disclosed
US-20210290771-A1 ENGINEERED RECEPTOR/LIGAND SYSTEM FOR DELIVERY OF THERAPEUTIC AGENTS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) 2021-09-23 US disclosed
US-11052046-B2 Method for preparing micro-particles by double emulsion technique NANOMI B.V. (NL) 2021-07-06 US disclosed
US-11000597-B2 Engineered receptor/ligand system for delivery of therapeutic agents UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) 2021-05-11 US disclosed
US-20210015752-A1 METHODS FOR PRODUCING PARTICLES OF AN ACTIVE INGREDIENT SAVIOR LIFETEC CORPORATION (TW) 2021-01-21 US disclosed
EP-3687503-A1 METHOD FOR PREPARING MICRO-PARTICLES BY DOUBLE EMULSION TECHNIQUE Nanomi B.V. (NL) 2020-08-05 EP disclosed
EP-0145240-B1 METHOD FOR PRODUCING MICROCAPSULE Takeda Chemical Industries, Ltd. (JP) 1989-04-19 EP disclosed
US-4711782-A Prolonged release microcapsules and their production TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1987-12-08 US disclosed
US-4652441-A WATER SOLUBLE DRUGS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1987-03-24 US disclosed
EP-0190833-A2 Method for producing microcapsule Takeda Chemical Industries, Ltd. (JP) 1986-08-13 EP disclosed
EP-0145240-A2 Method for producing Microcapsule Takeda Chemical Industries, Ltd. (JP) 1985-06-19 EP disclosed
EP-0103830-A2 Phenylethylemine derivatires as growth stimulators BAYER AG (DE) 1984-03-28 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-20030236298-A1 1,3-bis-(substituted-phenyl)-2-propen-1-ones and their use to treat VCAM-1 mediated disorders VCAM1, ICAM1, ITGB1 ADRB2 86/4885ADRB1 24/4885ADRB3 163/4885
US-20060258735-A1 1,3-Bis-(substituted-phenyl)-2-propen-1-ones and their use to treat VCAM-1 mediated disorders VCAM1, ICAM1, ITGB1 ADRB2 86/4885ADRB1 24/4885ADRB3 163/4885

“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.