SCHEMBL600518

SCHEMBL600518

O=C1NC(=O)C(c2ccsc2)=C1c1ccsc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 1/20 0.45
CYP2A6 P11509 3/20 0.43
CYP2B6 P20813 2/20 0.43
CYP2E1 P05181 1/20 0.43
STK10 O94804 2/20 0.43
SLK Q9H2G2 2/20 0.43
POLB P06746 1/20 0.40
MAPT P10636 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
CHEK1 O14757 1/20 0.38
WEE1 P30291 1/20 0.38
PTPRC P08575 1/20 0.38
MMP2 P08253 1/20 0.37
MMP9 P14780 1/20 0.37
MMP8 P22894 1/20 0.37
PTGS2 P35354 3/20 0.37
PIM1 P11309 1/20 0.37
USP2 O75604 1/20 0.37
ALDH1A1 P00352 1/20 0.37
PKM P14618 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
SCHEMBL12459108 0.83 GSK3B (0.42) GSK3BCYP2A6CYP2B6CYP2E1STK10
SCHEMBL19216926 0.75 PRKCB (0.48) STK10SLKMAPTCHEK1WEE1
SCHEMBL8161280 0.74 CCNE2 (0.72) GSK3B
SCHEMBL8980802 0.71 CHEK1 (0.44) GSK3BCYP2A6CYP2B6CYP2E1STK10
SCHEMBL15731559 0.71 CYP2A6 (0.42) CYP2A6CYP2B6CYP2E1PTPRCPTGS2
Formaldehyde SCHEMBL28680174 0.69 CYP2A6 (0.62) CYP2A6CYP2B6CYP2E1PTPRCKCNH2
SCHEMBL12393918 0.68 GSK3B (0.33) GSK3BSTK10SLKPIM1
SCHEMBL4180952 0.66 CES1 (0.50) GSK3BCYP2A6CYP2B6CYP2E1STK10
SCHEMBL27989815 0.66 CYP2A6 (0.74) GSK3BCYP2A6CYP2B6CYP2E1PTPRC
SCHEMBL3966035 0.66 GSK3B (0.40) GSK3BCYP2A6CYP2B6CYP2E1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111315762-B Optically controlled switch with affinity tag and method of use thereof 加利福尼亚大学董事会 2024-04-16 CN disclosed
WO-2023220526-A1 COMPOSITIONS AND METHODS FOR MODULATING DOPAMINE RECEPTOR ACTIVITY THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-11-16 WO disclosed
CN-116669811-A Compositions and methods for enhancing visual function 加利福尼亚大学董事会 2023-08-29 CN disclosed
US-20230173090-A1 COMPOSITIONS AND METHODS FOR MODULATING DOPAMINE RECEPTOR ACTIVITY THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2023-06-08 US disclosed
WO-2023097186-A1 COMPOSITIONS AND METHODS FOR ENHANCING VISUAL FUNCTION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-06-01 WO disclosed
EP-4172187-A1 COMPOSITIONS AND METHODS FOR MODULATING DOPAMINE RECEPTOR ACTIVITY The Regents of the University of California (US) 2023-05-03 EP disclosed
EP-4158002-A1 COMPOSITIONS AND METHODS FOR ENHANCING VISUAL FUNCTION The Regents of the University of California (US) 2023-04-05 EP disclosed
WO-2022006071-A1 COMPOSITIONS AND METHODS FOR MODULATING DOPAMINE RECEPTOR ACTIVITY THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2022-01-06 WO disclosed
WO-2021243086-A1 COMPOSITIONS AND METHODS FOR ENHANCING VISUAL FUNCTION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-12-02 WO disclosed
US-20210369744-A1 COMPOSITIONS AND METHODS FOR ENHANCING VISUAL FUNCTION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2021-12-02 US disclosed
US-8309350-B2 Photoreactive regulator of protein function and methods of use thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-11-13 US disclosed
US-20120190094-A1 Photoreactive Regulator of Protein Function and Methods of Use Thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2012-07-26 US disclosed
US-8178496-B2 Photoreactive regulator of glutamate receptor function and methods of use thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-05-15 US disclosed
US-8114843-B2 Photoreactive regulator of protein function and methods of use thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-02-14 US disclosed
US-20110207213-A1 Photoreactive Synthetic Regulator of Protein Function and Methods of Use Thereof ENERGY, UNITED STATES DEPARTMENT OF 2011-08-25 US disclosed
US-20100330607-A1 PHOTOSWITCH-ENABLED ION CHANNEL ASSAY SYSTEM PHOTOSWITCH BIOSCIENCES, INC. (US) 2010-12-30 US disclosed
WO-2010151609-A1 PHOTOSWITCH-ENABLED ION CHANNEL ASSAY SYSTEM PHOTOSWITCH BIOSCIENCES INC. (US) 2010-12-29 WO disclosed
WO-2010051343-A1 PHOTOREACTIVE SYNTHETIC REGULATOR OF PROTEIN FUNCTION AND METHODS OF USE THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2010-05-06 WO disclosed
US-20090181454-A1 PHOTOREACTIVE REGULATOR OF GLUTAMATE RECEPTOR FUNCTION AND METHODS OF USE THEREOF ENERGY, UNITED STATE DEPARTMENT OF 2009-07-16 US disclosed
US-20070128662-A1 Photoreactive regulator of protein function and methods of use thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2007-06-07 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 (5 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-20210369744-A1 COMPOSITIONS AND METHODS FOR ENHANCING VISUAL FUNCTION PDE6C, UACA, EPHA2 GSK3B 4410/4885CYP2A6 4645/4885CYP2B6 4649/4885
US-20090181454-A1 PHOTOREACTIVE REGULATOR OF GLUTAMATE RECEPTOR FUNCTION AND METHODS OF USE THEREOF GRM2, GRM1, GRM3 GSK3B 4744/4885CYP2A6 4490/4885CYP2B6 4669/4885
US-20230173090-A1 COMPOSITIONS AND METHODS FOR MODULATING DOPAMINE RECEPTOR ACTIVITY PARK7, PRLHR, SNCA GSK3B 2655/4885CYP2A6 4712/4885CYP2B6 4794/4885
US-20070128662-A1 Photoreactive regulator of protein function and methods of use thereof PPP1R10, PPP6R3, ANKRD52 GSK3B 4713/4885CYP2A6 4534/4885CYP2B6 4828/4885
US-20110207213-A1 Photoreactive Synthetic Regulator of Protein Function and Methods of Use Thereof PPP1R10, PPP6R1, PPP6R3 GSK3B 4782/4885CYP2A6 4626/4885CYP2B6 4823/4885

“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.