SCHEMBL173078

SCHEMBL173078

COCCCOP(=O)(O)COCCn1cnc2c(N)ncnc21

nearest known ligand 0.80

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 3/20 0.80
SLC22A6 Q4U2R8 2/20 0.71
ABCB11 O95342 1/20 0.59
POLA1 P09884 1/20 0.59
POLG P54098 1/20 0.59
FAP Q12884 1/20 0.59
CYP2D6 P10635 13/20 0.58
CYP3A4 P08684 11/20 0.58
ENPP1 P22413 1/20 0.56

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
SCHEMBL97302 0.89 FGFR1 (1.00) FGFR1SLC22A6CYP2D6CYP3A4
SCHEMBL12875233 0.88 FGFR1 (0.78) FGFR1SLC22A6ABCB11POLA1POLG
SCHEMBL29258953 0.87 FGFR1 (0.77) FGFR1SLC22A6ABCB11POLA1POLG
SCHEMBL20644336 0.86 FGFR1 (0.73) FGFR1SLC22A6ABCB11POLA1POLG
SCHEMBL16020629 0.85 FGFR1 (0.93) FGFR1SLC22A6ABCB11POLA1POLG
SCHEMBL20644337 0.85 FGFR1 (0.68) FGFR1SLC22A6ABCB11POLA1POLG
SCHEMBL20644448 0.85 FGFR1 (0.85) FGFR1SLC22A6ABCB11POLA1POLG
SCHEMBL16063254 0.84 FGFR1 (0.68) FGFR1SLC22A6ABCB11POLA1POLG
SCHEMBL12391574 0.84 FGFR1 (0.68) FGFR1SLC22A6ABCB11POLA1POLG
SCHEMBL16063265 0.84 FGFR1 (0.68) FGFR1SLC22A6ABCB11POLA1POLG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8309565-B2 Phosphonate compounds THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-11-13 US disclosed
US-20120058975-A1 Phosphonate Compounds THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2012-03-08 US disclosed
US-8008308-B2 Phosphonate compounds THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2011-08-30 US disclosed
US-20110015149-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR THE TREATMENT OF VIRAL INFECTIONS AND OTHER MEDICAL DISORDERS CHIMERIX, INC. 2011-01-20 US disclosed
US-7790703-B2 New phosphonate ester derivatives of purine or pyrimidine antivirals; side effect reduction, less toxic, bioavailability THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2010-09-07 US disclosed
US-20100173870-A1 Phosphonate Compounds THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2010-07-08 US disclosed
US-7687480-B2 Alkylpropanediol derivatized adefovir; reduced toxicity; osteoporosis, bone metabolism disorders , cancer, viral infections THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2010-03-30 US disclosed
US-7452898-B2 Use of 1-O-octadecylpropanediol-3-cidofovir to treat viral diseases such as HIV, influenza, herpes virus, cytomegalovirus, hepatitis virus, Epstein-Barr virus, varicella zoster virus, orthopox virus, ebola virus and papilloma virus THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2008-11-18 US disclosed
US-20080103115-A1 Alkylpropanediol derivatized adefovir; reduced toxicity; osteoporosis, bone metabolism disorders , cancer, viral infections THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2008-05-01 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-20080103115-A1 Alkylpropanediol derivatized adefovir; reduced toxicity; osteoporosis, bone metabolism disorders , cancer, viral infections APRT, AASDHPPT, APOBEC3G FGFR1 2772/4885SLC22A6 1664/4885ABCB11 2912/4885
US-20110015149-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR THE TREATMENT OF VIRAL INFECTIONS AND OTHER MEDICAL DISORDERS ACE, CYP27A1, LIPC FGFR1 3111/4885SLC22A6 534/4885ABCB11 154/4885
US-20120058975-A1 Phosphonate Compounds PHPT1, PHOSPHO1, PIK3CA FGFR1 1716/4885SLC22A6 903/4885ABCB11 1882/4885
US-20100173870-A1 Phosphonate Compounds PHPT1, PHOSPHO1, PIK3CA FGFR1 1716/4885SLC22A6 903/4885ABCB11 1882/4885

“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.