SCHEMBL14769121

SCHEMBL14769121

O=P(O)(O)Cc1ccc2ccccc2n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PGK1 P00558 1/20 0.60
PGK2 P07205 1/20 0.60
CYP1A2 P05177 1/20 0.50
CYSLTR1 Q9Y271 2/20 0.46
CYSLTR2 Q9NS75 1/20 0.46
ALDH1A1 P00352 1/20 0.46
GAA P10253 1/20 0.46
MAPT P10636 1/20 0.46
ACP3 P15309 1/20 0.44
GPBAR1 Q8TDU6 1/20 0.44
HDAC8 Q9BY41 1/20 0.43
MGAM O43451 1/20 0.43

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
SCHEMBL1585265 0.98 PGK1 (0.58) PGK1PGK2CYP1A2CYSLTR1CYSLTR2
SCHEMBL1585270 0.98 PGK1 (0.58) PGK1PGK2CYP1A2CYSLTR1CYSLTR2
SCHEMBL27765219 0.81 CYP1A2 (0.46) CYP1A2CYSLTR1CYSLTR2ALDH1A1GAA
SCHEMBL1585267 0.80 CYP1A2 (0.45) CYP1A2CYSLTR1CYSLTR2ALDH1A1GAA
SCHEMBL28322707 0.79 ALDH1A1 (0.53) CYP1A2CYSLTR1CYSLTR2ALDH1A1GAA
SCHEMBL9005990 0.77 CYP1A2 (0.46) CYP1A2CYSLTR1CYSLTR2ALDH1A1GPBAR1
SCHEMBL8183037 0.77 PGK1 (0.50) PGK1PGK2
SCHEMBL10374296 0.76 PDE10A (0.58) PGK1PGK2CYP1A2ALDH1A1GAA
SCHEMBL2401081 0.75 CYP1A2 (0.44) CYP1A2CYSLTR1CYSLTR2ALDH1A1GAA
SCHEMBL29426992 0.75 CYP1A2 (0.44) CYP1A2CYSLTR1CYSLTR2ALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240208902-A1 CYCLOBUTYL AMIDE MONOACYLGLYCEROL LIPASE MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2024-06-27 US disclosed
US-11802111-B2 Cyclobutyl amide monoacylglycerol lipase modulators JANSSEN PHARMACEUTICA NV (BE) 2023-10-31 US disclosed
EP-4217062-A1 CYCLOBUTYL AMIDE MONOACYLGLYCEROL LIPASE MODULATORS JANSSEN Pharmaceutica NV (BE) 2023-08-02 EP disclosed
US-9193736-B2 PDE 10a inhibitors for the treatment of type II diabetes JANSSEN PHARMACEUTICA, NV (BE) 2015-11-24 US disclosed
US-20140364413-A1 PDE 10a Inhibitors for the Treatment of Type II Diabetes JANSSEN PHARMACEUTICA, NV (BE) 2014-12-11 US disclosed
US-20130065857-A1 NOVEL DXR INHIBITORS FOR ANTIMICROBIAL THERAPY BAYLOR COLLEGE OF MEDICINE (US) 2013-03-14 US disclosed
US-20130065857-A1 NOVEL DXR INHIBITORS FOR ANTIMICROBIAL THERAPY BAYLOR COLLEGE OF MEDICINE (US) 2013-03-14 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 (4 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-20140364413-A1 PDE 10a Inhibitors for the Treatment of Type II Diabetes PDE2A, PDE3B, PDE3A PGK1 1401/4885PGK2 616/4885CYP1A2 629/4885
US-20130065857-A1 NOVEL DXR INHIBITORS FOR ANTIMICROBIAL THERAPY DDX18, FPR1, DCXR PGK1 1613/4885PGK2 1758/4885CYP1A2 4027/4885
US-20240208902-A1 CYCLOBUTYL AMIDE MONOACYLGLYCEROL LIPASE MODULATORS MGLL, LPL, PNLIP PGK1 1351/4885PGK2 1512/4885CYP1A2 634/4885
US-11802111-B2 Cyclobutyl amide monoacylglycerol lipase modulators MGLL, LPL, PNLIP PGK1 1335/4885PGK2 1472/4885CYP1A2 618/4885

“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.