SCHEMBL19638038

SCHEMBL19638038

COc1ccc(-c2nc(NC(=O)c3cc(C(=O)O)n[nH]3)sc2C#N)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 6/20 0.51
ADORA1 P30542 5/20 0.46
ADORA2A P29274 2/20 0.46
LMNA P02545 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
PTBP1 P26599 1/20 0.44
MAPT P10636 5/20 0.44
ALDH1A1 P00352 2/20 0.44
KDM4E B2RXH2 1/20 0.44
GAA P10253 1/20 0.44
ALPL P05186 1/20 0.44
CA9 Q16790 1/20 0.44
MEN1 O00255 5/20 0.44
KMT2A Q03164 5/20 0.44
USP2 O75604 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
RECQL P46063 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
THRB P10828 1/20 0.43

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
SCHEMBL19637998 0.83 ADORA3 (0.54) ADORA3ADORA1ADORA2ALMNASMN1; SMN2
SCHEMBL19638140 0.83 ADORA3 (0.63) ADORA3ADORA1ADORA2ALMNASMN1; SMN2
SCHEMBL19638094 0.80 ADORA3 (0.55) ADORA3ADORA1ADORA2ALMNASMN1; SMN2
SCHEMBL17951287 0.80 ADORA3 (0.57) ADORA3ADORA1ADORA2ASMN1; SMN2MAPT
SCHEMBL19638083 0.79 DDX3X (0.62) ADORA3ADORA1ADORA2ALMNAMAPT
SCHEMBL30309274 0.73 ADORA3 (0.65) ADORA3ADORA1ADORA2ALMNASMN1; SMN2
SCHEMBL22331559 0.73 ADORA3 (0.65) ADORA3ADORA1ADORA2ALMNASMN1; SMN2
SCHEMBL19638387 0.71 ADORA3 (0.57) ADORA3ADORA1ADORA2ALMNASMN1; SMN2
SCHEMBL19638055 0.71 ADORA2A (0.65) ADORA3ADORA1ADORA2ALMNASMN1; SMN2
SCHEMBL18230411 0.71 ADORA3 (0.61) ADORA3ADORA1ADORA2AMAPTALDH1A1

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 1/4885ADORA1 3/4885ADORA2A 2/4885
US-10238637-B2 Modulators of the adenosine A3 receptors ADORA3, ADORA2A, ADORA1 ADORA3 1/4885ADORA1 3/4885ADORA2A 2/4885

“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.