SCHEMBL97602

SCHEMBL97602

Nc1ncnc2c1ncn2CCOCC=O

nearest known ligand 0.65

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 1/20 0.65
SLC22A6 Q4U2R8 1/20 0.65
ADORA2A P29274 5/20 0.57
ADORA1 P30542 2/20 0.57
ADORA2B P29275 1/20 0.57
NSD3 Q9BZ95 6/20 0.56
NSD2 O96028 5/20 0.56
LMNA P02545 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
CA1 P00915 1/20 0.55
CA2 P00918 1/20 0.55
CA4 P22748 1/20 0.55
CA9 Q16790 1/20 0.55
HPGD P15428 1/20 0.54
ADCY5 O95622 1/20 0.54

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
SCHEMBL1920120 0.82 FGFR1 (0.67) FGFR1SLC22A6ADORA2AADORA1ADORA2B
SCHEMBL2023978 0.82 FGFR1 (0.70) FGFR1SLC22A6ADORA2AADORA1ADORA2B
SCHEMBL382916 0.82 FGFR1 (0.66) FGFR1SLC22A6ADORA2AADORA1ADORA2B
SCHEMBL4364344 0.82 ADORA2A (0.70) FGFR1SLC22A6ADORA2AADORA1ADORA2B
SCHEMBL1920123 0.81 FGFR1 (0.65) FGFR1SLC22A6ADORA2AADORA1ADORA2B
SCHEMBL2032130 0.79 FGFR1 (0.62) FGFR1SLC22A6ADORA2AADORA1ADORA2B
SCHEMBL13114340 0.79 FGFR1 (0.77) FGFR1SLC22A6ADORA2AADORA1ADORA2B
SCHEMBL3304318 0.79 FGFR1 (0.66) FGFR1SLC22A6ADORA2AADORA1ADORA2B
Adefovir SCHEMBL49373 0.79 FGFR1 (1.00) FGFR1SLC22A6ADORA2AADORA1ADORA2B
Adefovir SCHEMBL29365535 0.79 FGFR1 (1.00) FGFR1SLC22A6ADORA2AADORA1ADORA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170239279-A1 PHOSPHONATE COMPOUNDS UNIV CALIFORNIA (US) 2017-08-24 US disclosed
US-9649321-B2 Phosphonate compounds THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-05-16 US disclosed
US-20160067268-A1 PHOSPHONATE COMPOUNDS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2016-03-10 US disclosed
US-9206208-B2 Phosphonate compounds THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2015-12-08 US disclosed
US-20150141375-A1 Methods of Treating Viral Associated Diseases CHIMERIX, INC. 2015-05-21 US disclosed
US-20150051174-A1 Phosphonate Compounds NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-02-19 US disclosed
US-8889658-B2 Phosphonate compounds THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2014-11-18 US disclosed
US-20140045794-A1 Phosphonate Compounds THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2014-02-13 US disclosed
US-20130072458-A1 Methods of Treating Viral Associated Diseases CHIMERIX, INC. (US) 2013-03-21 US disclosed
US-8309565-B2 Phosphonate compounds THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-11-13 US disclosed
US-20120164104-A1 Composition and Methods of Treating Viral Infections and Viral Induced Tumors CHIMERIX, INC. (US) 2012-06-28 US disclosed
US-20120058975-A1 Phosphonate Compounds THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2012-03-08 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 (8 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-20150051174-A1 Phosphonate Compounds PHPT1, PHOSPHO1, PIK3CA FGFR1 1716/4885SLC22A6 903/4885ADORA2A 720/4885
US-20140045794-A1 Phosphonate Compounds PHPT1, PHOSPHO1, PIK3CA FGFR1 1716/4885SLC22A6 903/4885ADORA2A 720/4885
US-20130072458-A1 Methods of Treating Viral Associated Diseases HAVCR2, EIF2AK2, TSLP FGFR1 4116/4885SLC22A6 2295/4885ADORA2A 914/4885
US-20170239279-A1 PHOSPHONATE COMPOUNDS PHPT1, PHOSPHO1, PIK3CA FGFR1 1716/4885SLC22A6 903/4885ADORA2A 720/4885
US-20120058975-A1 Phosphonate Compounds PHPT1, PHOSPHO1, PIK3CA FGFR1 1716/4885SLC22A6 903/4885ADORA2A 720/4885
US-20160067268-A1 PHOSPHONATE COMPOUNDS PHPT1, PHOSPHO1, PIK3CA FGFR1 1716/4885SLC22A6 903/4885ADORA2A 720/4885
US-20150141375-A1 Methods of Treating Viral Associated Diseases HAVCR2, EIF2AK2, TSLP FGFR1 4116/4885SLC22A6 2295/4885ADORA2A 914/4885
US-20120164104-A1 Composition and Methods of Treating Viral Infections and Viral Induced Tumors HAVCR2, IRF3, CCL5 FGFR1 1945/4885SLC22A6 3517/4885ADORA2A 754/4885

“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.