SCHEMBL19638058

SCHEMBL19638058

N#CCC(=O)c1cc(Cl)cs1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 3/20 0.41
KCNH2 Q12809 1/20 0.38
MELK Q14680 1/20 0.38
MAPT P10636 4/20 0.37
ABL1 P00519 4/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
KDM4E B2RXH2 2/20 0.36
GAA P10253 2/20 0.36
RECQL P46063 1/20 0.36
ALAD P13716 1/20 0.34
PTGS2 P35354 1/20 0.33
CYP2A6 P11509 1/20 0.32
S1PR1 P21453 1/20 0.32
S1PR3 Q99500 1/20 0.32

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
SCHEMBL15988713 0.79 GSK3B (0.47) GSK3BMELKMAPTMEN1KMT2A
SCHEMBL22953102 0.76 GSK3B (0.48) GSK3BMAPTMEN1KMT2AALAD
SCHEMBL13116478 0.76 GSK3B (0.44) GSK3BMELKMAPTMEN1KMT2A
SCHEMBL10513732 0.76 GSK3B (0.44) GSK3BMELKMAPTMEN1KMT2A
Hydrochloric Acid SCHEMBL4266714 0.74 GSK3B (0.43) GSK3BMELKMAPTMEN1KMT2A
SCHEMBL27577455 0.73 GSK3B (0.42) GSK3BMELKMAPTMEN1KMT2A
SCHEMBL15979708 0.70 DAO (0.52) GSK3BMAPTMEN1KMT2AALAD
SCHEMBL1771045 0.70
SCHEMBL788121 0.70
SCHEMBL4945211 0.69 TPMT (0.46) GSK3BKCNH2MAPTMEN1KMT2A

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 11 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
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
US-10744125-B2 Adenosine A3 receptor modulators PALOBIOFARMA, S.L. (ES) 2020-08-18 US 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
WO-2018134464-A1 ADENOSINE A3 RECEPTOR MODULATORS PALOBIOFARMA, S.L. (ES) 2018-07-26 WO 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 (3 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 GSK3B 2022/4885KCNH2 3582/4885MELK 2556/4885
US-10744125-B2 Adenosine A3 receptor modulators ADORA3, ADORA2A, ADORA1 GSK3B 1758/4885KCNH2 1708/4885MELK 2566/4885
US-10238637-B2 Modulators of the adenosine A3 receptors ADORA3, ADORA2A, ADORA1 GSK3B 2022/4885KCNH2 3582/4885MELK 2556/4885

“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.