SCHEMBL15535289

SCHEMBL15535289

Cc1cc(-c2ccc(C(F)(F)F)cc2)nc(C=O)n1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 1/20 0.47
RAD51 Q06609 1/20 0.45
MAPT P10636 2/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
SCN9A Q15858 2/20 0.41
CTSS P25774 1/20 0.40
CTSK P43235 1/20 0.40
TOP1 P11387 2/20 0.40
LMNA P02545 1/20 0.38
THRB P10828 1/20 0.38
PPARD Q03181 2/20 0.38
LTA4H P09960 1/20 0.38
GSTO1 P78417 1/20 0.38
KIF11 P52732 1/20 0.37
SDHB P21912 1/20 0.37
MAOB P27338 1/20 0.37
POLB P06746 1/20 0.36
MAPK1 P28482 1/20 0.36

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
SCHEMBL19262292 0.85 RAD51 (0.42) ADORA3RAD51MAPTNPC1RAB9A
SCHEMBL19510145 0.82 RAD51 (0.40) ADORA3RAD51MAPTNPC1RAB9A
SCHEMBL16804872 0.79 RAD51 (0.47) ADORA3RAD51MAPTNPC1RAB9A
SCHEMBL15533905 0.76 RAD51 (0.45) ADORA3RAD51MAPTNPC1RAB9A
SCHEMBL3561445 0.76 ALDH1A1 (0.47) ADORA3RAD51MAPTNPC1RAB9A
SCHEMBL19262265 0.76 RAD51 (0.45) ADORA3RAD51MAPTNPC1RAB9A
SCHEMBL16804876 0.76 ADORA3 (0.53) ADORA3RAD51MAPTNPC1RAB9A
SCHEMBL3556359 0.76 ADORA3 (0.50) ADORA3RAD51MAPTNPC1RAB9A
SCHEMBL4900477 0.75 ADORA3 (0.56) ADORA3PPARDMAPK1
SCHEMBL12539196 0.75 KIF11 (0.43) ADORA3TOP1LTA4HGSTO1KIF11

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200289508-A1 NOVEL PYRIMIDINYL-DIAZOSPIRO COMPOUNDS Convergence Pharmaceuticals Limited (GB) 2020-09-17 US disclosed
US-10010551-B2 Pyrimidinyl-diazospiro compounds Convergence Pharmaceuticals Limited (GB) 2018-07-03 US disclosed
US-10010551-B2 Pyrimidinyl-diazospiro compounds Convergence Pharmaceuticals Limited (GB) 2018-07-03 US disclosed
US-20170304303-A1 Novel Pyrimidinyl-DiazoSpiro Compounds Convergence Pharmaceuticals Limited (GB) 2017-10-26 US disclosed
US-20170304303-A1 Novel Pyrimidinyl-DiazoSpiro Compounds Convergence Pharmaceuticals Limited (GB) 2017-10-26 US disclosed
US-9737536-B2 Pyrimidinyl-diazospiro compounds Convergence Pharmaceuticals Limited (GB) 2017-08-22 US disclosed
US-9737536-B2 Pyrimidinyl-diazospiro compounds Convergence Pharmaceuticals Limited (GB) 2017-08-22 US disclosed
EP-3106464-A1 NOVEL COMPOUNDS Convergence Pharmaceuticals Limited (GB) 2016-12-21 EP disclosed
US-20160263115-A1 Novel Pyrimidinyl-DiazoSpiro Compounds Convergence Pharmaceuticals Limited (GB) 2016-09-15 US disclosed
US-20160263115-A1 Novel Pyrimidinyl-DiazoSpiro Compounds Convergence Pharmaceuticals Limited (GB) 2016-09-15 US disclosed
EP-2861602-B1 7-Methyl-2-[4-methyl-6-[4-(trifluoromethyl)-phenyl]pyrimidin-2-yl]-1,7-diazaspiro[4.4]nonan-6-one CONVERGENCE PHARMACEUTICALS (GB) 2016-08-10 EP disclosed
US-20160184306-A1 Novel Pyrimidinyl-DiazoSpiro Compounds Convergence Pharmaceuticals Limited (GB) 2016-06-30 US disclosed
US-9376445-B2 Pyrimidinyl-diazospiro compounds Convergence Pharmaceuticals Limited (GB) 2016-06-28 US disclosed
US-9376445-B2 Pyrimidinyl-diazospiro compounds Convergence Pharmaceuticals Limited (GB) 2016-06-28 US disclosed
US-9309254-B2 Pyrimidinyl-diazospiro compounds Convergence Pharmaceuticals Limited (GB) 2016-04-12 US disclosed
US-20150166551-A1 NOVEL COMPOUNDS Convergence Pharmaceuticals Limited (GB) 2015-06-18 US disclosed
US-20150166551-A1 NOVEL COMPOUNDS Convergence Pharmaceuticals Limited (GB) 2015-06-18 US disclosed
US-20150119404-A1 NOVEL COMPOUNDS CONVERGANCE PHARMACEUTICALS LIMITED (GB) 2015-04-30 US disclosed
EP-2861594-A1 NOVEL COMPOUNDS Convergence Pharmaceuticals Limited (GB) 2015-04-22 EP disclosed
WO-2013175206-A1 NOVEL COMPOUNDS Convergence Pharmaceuticals Limited (GB) 2013-11-28 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 (7 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-20160184306-A1 Novel Pyrimidinyl-DiazoSpiro Compounds TRPV1, KCNJ2, KCNN2 ADORA3 1428/4885RAD51 4602/4885MAPT 3413/4885
US-20200289508-A1 NOVEL PYRIMIDINYL-DIAZOSPIRO COMPOUNDS TRPV1, KCNJ2, KCNN2 ADORA3 1428/4885RAD51 4602/4885MAPT 3413/4885
US-20150166551-A1 NOVEL COMPOUNDS KCNJ2, KCNN2, KCNN3 ADORA3 2155/4885RAD51 4815/4885MAPT 2349/4885
US-20160263115-A1 Novel Pyrimidinyl-DiazoSpiro Compounds TRPV1, KCNJ2, SCN1A ADORA3 1622/4885RAD51 4520/4885MAPT 2731/4885
US-10010551-B2 Pyrimidinyl-diazospiro compounds KCNJ2, TRPV1, SCN2A ADORA3 1278/4885RAD51 4436/4885MAPT 3125/4885
US-20170304303-A1 Novel Pyrimidinyl-DiazoSpiro Compounds TRPV1, KCNJ2, KCNN2 ADORA3 1610/4885RAD51 4651/4885MAPT 3284/4885
US-20150119404-A1 NOVEL COMPOUNDS KCNJ2, KCNN3, KCNN2 ADORA3 1734/4885RAD51 4842/4885MAPT 2761/4885

“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.