SCHEMBL4085196

SCHEMBL4085196

O=c1[nH]c(-c2ccccc2O[PH](=O)OO)nc2ccccc12

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GUSB P08236 10/20 0.60
▸ KDM4E B2RXH2 2/20 0.58
▸ HPGD P15428 2/20 0.58
▸ TNKS O95271 3/20 0.50
▸ TNKS2 Q9H2K2 3/20 0.50
▸ PARP1 P09874 2/20 0.50
▸ ALDH1A1 P00352 3/20 0.49
▸ MAPT P10636 2/20 0.49
▸ PARP2 Q9UGN5 1/20 0.48
▸ NPC1 O15118 1/20 0.48
▸ LMNA P02545 1/20 0.48
▸ GAA P10253 1/20 0.48
▸ HTT P42858 1/20 0.48
▸ RAB9A P51151 1/20 0.48
▸ HIF1A Q16665 1/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ ALOX15 P16050 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ APOBEC3G Q9HC16 1/20 0.46
▸ CYP1A1 P04798 1/20 0.46

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
SCHEMBL13604403 0.79 GUSB (0.69) GUSBKDM4EHPGDTNKSTNKS2
SCHEMBL29740691 0.79 GUSB (0.78) GUSBKDM4EHPGDTNKSTNKS2
SCHEMBL1084872 0.79 GUSB (0.78) GUSBKDM4EHPGDTNKSTNKS2
SCHEMBL4579539 0.78 GUSB (0.67) GUSBKDM4EHPGDTNKSTNKS2
SCHEMBL297069 0.77 GUSB (0.67) GUSBKDM4EHPGDTNKSTNKS2
SCHEMBL14845878 0.77 GUSB (0.63) GUSBKDM4EHPGDTNKSTNKS2
SCHEMBL4579536 0.77 GUSB (0.63) GUSBKDM4EHPGDTNKSTNKS2
SCHEMBL7160589 0.75 GUSB (1.00) GUSBKDM4EHPGD
SCHEMBL31238756 0.75 GUSB (1.00) GUSBKDM4EHPGD
SCHEMBL10205334 0.75 GUSB (0.68) GUSBKDM4EHPGDTNKSTNKS2

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-20160158390-A1 Methods for Tumor Diagnosis and Therapy PRESIDENT AND FELLOWS OF HARVARD COLLEGE 2016-06-09 — — US disclosed
US-9186425-B2 Methods for tumor diagnosis and therapy PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2015-11-17 — — US disclosed
US-20140178298-A1 METHODS FOR TUMOR DIAGNOSIS AND THERAPY PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2014-06-26 — — US disclosed
US-20120213701-A1 METHODS FOR TUMOR DIAGNOSIS AND THERAPY PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2012-08-23 — — US disclosed
US-8168159-B2 Compounds for tumor diagnosis and therapy PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2012-05-01 — — US disclosed
US-20090285755-A1 METHODS FOR TUMOR DIAGNOSIS AND THERAPY PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2009-11-19 — — US disclosed
US-7514067-B2 Complexing enzyme with antibody; trapping within tumor PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2009-04-07 — — 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 (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-20120213701-A1 METHODS FOR TUMOR DIAGNOSIS AND THERAPY FOLH1, DNPEP, ENPEP GUSB 21/4885KDM4E 4072/4885HPGD 595/4885
US-20090285755-A1 METHODS FOR TUMOR DIAGNOSIS AND THERAPY FOLH1, DNPEP, ENPEP GUSB 21/4885KDM4E 4072/4885HPGD 595/4885
US-20140178298-A1 METHODS FOR TUMOR DIAGNOSIS AND THERAPY FOLH1, DNPEP, ENPEP GUSB 21/4885KDM4E 4072/4885HPGD 595/4885
US-20160158390-A1 Methods for Tumor Diagnosis and Therapy FOLH1, DNPEP, ENPEP GUSB 21/4885KDM4E 4072/4885HPGD 595/4885

“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.

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