SCHEMBL1853759

SCHEMBL1853759

N#Cc1sc(N)nc1-c1ccncc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 1/20 0.60
DBF4 Q9UBU7 1/20 0.60
ADORA1 P30542 2/20 0.47
ADORA2A P29274 1/20 0.47
ALDH1A1 P00352 3/20 0.42
KDM4E B2RXH2 3/20 0.42
HPGD P15428 2/20 0.42
HSD17B10 Q99714 2/20 0.42
CYP3A4 P08684 1/20 0.42
ALOX15 P16050 1/20 0.42
PIK3CD O00329 2/20 0.41
PIK3CA P42336 2/20 0.41
PIK3CB P42338 2/20 0.41
PIK3CG P48736 2/20 0.41
PIP5K1C O60331 1/20 0.41
PI4KA P42356 1/20 0.41
PI4KB Q9UBF8 1/20 0.41
MYC P01106 7/20 0.41
WDR5 P61964 7/20 0.41
MAPT P10636 2/20 0.40

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
SCHEMBL1449744 0.84 CDC7 (0.58) CDC7DBF4ADORA1ADORA2AALDH1A1
SCHEMBL19638228 0.83 MYC (0.44) CDC7DBF4ALDH1A1KDM4ECYP3A4
SCHEMBL28724215 0.81 MYC (0.61) CDC7DBF4ADORA1ADORA2AALDH1A1
SCHEMBL1852196 0.81 MYC (0.61) CDC7DBF4ADORA1ADORA2AALDH1A1
SCHEMBL1850222 0.81 ADORA2A (0.54) CDC7DBF4ADORA1ADORA2AALDH1A1
SCHEMBL22331510 0.80 ADORA1 (0.51) CDC7DBF4ADORA1ADORA2AMYC
SCHEMBL17951012 0.78 MYC (0.64) ADORA1ADORA2AALDH1A1KDM4EHPGD
SCHEMBL1849138 0.75 MYC (0.43) CDC7DBF4ADORA1ADORA2AALDH1A1
SCHEMBL23782480 0.74 KDM4E (0.55) ADORA1ADORA2AALDH1A1KDM4EHPGD
SCHEMBL19638105 0.74 ADORA1 (0.54) CDC7DBF4ADORA1ADORA2AMYC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110198939-B Modulators of adenosine A3 receptors 帕罗生物制药有限公司 2023-03-28 CN disclosed
CN-107207445-B Adenosine A3Modulators of receptors 帕罗生物制药有限公司 2021-03-16 CN disclosed
EP-3581572-B1 ADENOSINE A3 RECEPTOR MODULATORS PALOBIOFARMA SL (ES) 2020-11-25 EP disclosed
US-10744125-B2 Adenosine A3 receptor modulators PALOBIOFARMA, S.L. (ES) 2020-08-18 US disclosed
CN-110198939-A The regulator of adenosine A 3 receptor 帕罗生物制药有限公司 2019-09-03 CN disclosed
EP-3248964-B1 THIAZOLE MODULATORS OF A3 ADENOSINE RECEPTORS PALOBIOFARMA SL (ES) 2019-07-17 EP disclosed
US-10238637-B2 Modulators of the adenosine A3 receptors PALOBIOFARMA, S.L. (ES) 2019-03-26 US disclosed
US-20180263963-A1 MODULATORS OF THE ADENOSINE A3 RECEPTORS PALOBIOFARMA, S.L. (ES) 2018-09-20 US disclosed
EP-3248964-A1 THIAZOLE MODULATORS OF A3 ADENOSINE RECEPTORS PALOBIOFARMA S.L. (ES) 2017-11-29 EP disclosed
CN-101835766-B As adenosine A1Receptor antagonist compounds PALOBIOFARMA SL 2013-09-25 CN disclosed
US-8410282-B2 Compounds as adenosine A1 receptor antagonists PALOBIOFARMA, S.L. (ES) 2013-04-02 US disclosed
EP-2197860-B1 NEW COMPOUNDS AS ADENOSINE A1 RECEPTOR ANTAGONISTS PALOBIOFARMA SL (ES) 2011-05-25 EP disclosed
US-20100311703-A1 NEW COMPOUNDS AS ADENOSINE A1 RECEPTOR ANTAGONISTS PALOBIOFARMA, S.L. (ES) 2010-12-09 US disclosed
CN-101835766-A As adenosine A1Novel compounds of receptor antagonists PALOBIOFARMA SL 2010-09-15 CN disclosed
EP-2197860-A1 NEW COMPOUNDS AS ADENOSINE A1 RECEPTOR ANTAGONISTS Palobiofarma, S.L. (ES) 2010-06-23 EP disclosed
WO-2009044250-A1 NEW COMPOUNDS AS ADENOSINE A1 RECEPTOR ANTAGONISTS PALOBIOFARMA, S.L. (ES) 2009-04-09 WO 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-20180263963-A1 MODULATORS OF THE ADENOSINE A3 RECEPTORS ADORA3, ADORA2A, ADORA1 CDC7 4075/4885DBF4 3815/4885ADORA1 3/4885
US-10744125-B2 Adenosine A3 receptor modulators ADORA3, ADORA2A, ADORA1 CDC7 3551/4885DBF4 3257/4885ADORA1 3/4885
US-20100311703-A1 NEW COMPOUNDS AS ADENOSINE A1 RECEPTOR ANTAGONISTS ADORA1, ADORA2A, ADORA3 CDC7 1953/4885DBF4 2188/4885ADORA1 1/4885
US-10238637-B2 Modulators of the adenosine A3 receptors ADORA3, ADORA2A, ADORA1 CDC7 4075/4885DBF4 3815/4885ADORA1 3/4885

“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.