SCHEMBL4579536

SCHEMBL4579536

O=c1[nH]c(-c2ccccc2OP(=O)(O)O)nc2ccccc12

nearest known ligand 0.67

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GUSB P08236 11/20 0.63
HPGD P15428 2/20 0.60
KDM4E B2RXH2 1/20 0.60
TNKS O95271 3/20 0.52
TNKS2 Q9H2K2 3/20 0.52
PARP1 P09874 2/20 0.52
PARP2 Q9UGN5 1/20 0.50
ALDH1A1 P00352 1/20 0.48
MAPT P10636 1/20 0.48
ALOX15 P16050 1/20 0.48
HSD17B10 Q99714 1/20 0.48
APOBEC3G Q9HC16 1/20 0.48
CYP1A1 P04798 2/20 0.47
CYP1B1 Q16678 2/20 0.47
CYP1A2 P05177 1/20 0.47
HDAC8 Q9BY41 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47

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
SCHEMBL4188092 0.86 GUSB (0.47) GUSBHPGDKDM4ECYP1A1CYP1B1
Ammonia Solution, Strong SCHEMBL2685962 0.85 GUSB (0.46) GUSBHPGDKDM4ECYP1A1CYP1B1
SCHEMBL4579539 0.82 GUSB (0.67) GUSBHPGDKDM4ETNKSTNKS2
SCHEMBL1084872 0.81 GUSB (0.78) GUSBHPGDKDM4ETNKSTNKS2
SCHEMBL29740691 0.81 GUSB (0.78) GUSBHPGDKDM4ETNKSTNKS2
SCHEMBL13604403 0.81 GUSB (0.69) GUSBHPGDKDM4ETNKSTNKS2
SCHEMBL4847440 0.80 GUSB (0.65) GUSBHPGDKDM4ETNKSTNKS2
SCHEMBL297069 0.79 GUSB (0.67) GUSBHPGDKDM4ETNKSTNKS2
SCHEMBL14845878 0.79 GUSB (0.63) GUSBHPGDKDM4ETNKSTNKS2
SCHEMBL7160589 0.77 GUSB (1.00) GUSBHPGDKDM4E

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-20140349893-A1 LABELING OF IMMOBILIZED PROTEINS USING DIPYRROMETHENEBORON DIFLUORIDE DYES Life Technologies Corporation (US) 2014-11-27 US disclosed
US-20080182284-A1 Labeling or detecting of immobilized poly(amino acids), including peptides, polypeptides and proteins, on membranes and other solid supports; INVITROGEN CORPORATION (US) 2008-07-31 US disclosed
US-7348160-B2 Phosphoamidase assay MERCK PATENT GMBH (DE) 2008-03-25 US disclosed
US-7348160-B2 Phosphoamidase assay MERCK PATENT GMBH (DE) 2008-03-25 US disclosed
US-20050287618-A1 Labeling or detecting of immobilized poly(amino acids), including peptides, polypeptides and proteins, on membranes and other solid supports; HAUGLAND RICHARD P 2005-12-29 US disclosed
US-6972326-B2 immobilized poly(amino acids) are labeled or detected on blots or on arrays of poly(amino acids), or are attached to immobilized aptamers; use in analysis and diagnostics MOLECULAR PROBES, INC. (US) 2005-12-06 US disclosed
US-20050186641-A1 immobilized poly(amino acids) are labeled or detected on blots or on arrays of poly(amino acids), or are attached to immobilized aptamers; use in analysis and diagnostics MOLECULAR PROBES, INC. (US) 2005-08-25 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 (1 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-20050186641-A1 immobilized poly(amino acids) are labeled or detected on blots or on arrays of poly(amino acids), or are attached to immobilized aptamers; use in analysis and diagnostics PARN, DNPEP, PUF60 GUSB 3651/4885HPGD 4684/4885KDM4E 4169/4885

“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.