SCHEMBL19638066

SCHEMBL19638066

COc1ccc(-c2nc(NC(=O)c3ccc(C(=O)O)s3)sc2C#N)cn1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 5/20 0.46
ADORA2A P29274 1/20 0.45
PIK3CG P48736 1/20 0.42
POLQ O75417 2/20 0.39
KMT2A Q03164 3/20 0.39
LRRK2 Q5S007 1/20 0.38
MEN1 O00255 2/20 0.38
MAPT P10636 1/20 0.38
RAB9A P51151 2/20 0.38
POLB P06746 1/20 0.36
CSNK2A2 P19784 2/20 0.36
CSNK2A1 P68400 2/20 0.36
PTPN1 P18031 1/20 0.36
MKNK1 Q9BUB5 1/20 0.35
MKNK2 Q9HBH9 1/20 0.35

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
SCHEMBL19638441 0.94 ADORA3 (0.44) ADORA3ADORA2APIK3CGPOLQKMT2A
SCHEMBL19638094 0.86 ADORA3 (0.55) ADORA3ADORA2AKMT2AMEN1MAPT
SCHEMBL19638061 0.84 ADORA3 (0.49) ADORA3ADORA2APIK3CGPOLQKMT2A
SCHEMBL19638214 0.82 ADORA3 (0.48) ADORA3ADORA2APIK3CGPOLQKMT2A
SCHEMBL19638250 0.81 ADORA2A (0.54) ADORA3ADORA2AKMT2AMEN1MAPT
SCHEMBL19638113 0.81 ADORA2A (0.54) ADORA3ADORA2AKMT2AMEN1MAPT
SCHEMBL19637993 0.81 ADORA2A (0.65) ADORA3ADORA2AKMT2AMEN1MAPT
SCHEMBL22331566 0.81 ADORA3 (0.53) ADORA3ADORA2APIK3CGKMT2AMEN1
SCHEMBL30309282 0.81 ADORA3 (0.53) ADORA3ADORA2APIK3CGKMT2AMEN1
SCHEMBL19638387 0.80 ADORA3 (0.57) ADORA3ADORA2AKMT2AMEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107207445-B Adenosine A3Modulators of receptors 帕罗生物制药有限公司 2021-03-16 CN claimed
EP-3248964-B1 THIAZOLE MODULATORS OF A3 ADENOSINE RECEPTORS PALOBIOFARMA SL (ES) 2019-07-17 EP claimed
US-10238637-B2 Modulators of the adenosine A3 receptors PALOBIOFARMA, S.L. (ES) 2019-03-26 US claimed
US-20180263963-A1 MODULATORS OF THE ADENOSINE A3 RECEPTORS PALOBIOFARMA, S.L. (ES) 2018-09-20 US claimed
EP-3248964-A1 THIAZOLE MODULATORS OF A3 ADENOSINE RECEPTORS PALOBIOFARMA S.L. (ES) 2017-11-29 EP claimed
CN-107207445-B Adenosine A3Modulators of receptors 帕罗生物制药有限公司 2021-03-16 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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 ADORA3 1/4885ADORA2A 2/4885PIK3CG 899/4885
US-10238637-B2 Modulators of the adenosine A3 receptors ADORA3, ADORA2A, ADORA1 ADORA3 1/4885ADORA2A 2/4885PIK3CG 899/4885

“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.