SCHEMBL24601389

SCHEMBL24601389

CC(C)c1nc(NCc2ccccc2)c2ncn([C@@H]3O[C@H](C(=O)NCC(F)(F)F)[C@@H](O)[C@H]3O)c2n1

nearest known ligand 0.63

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 12/20 0.63
ADORA2A P29274 6/20 0.63
ADORA1 P30542 6/20 0.63
ADORA2B P29275 5/20 0.63
TSHR P16473 1/20 0.61

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
SCHEMBL29762224 1.00 ADORA3 (0.63) ADORA3ADORA2AADORA1ADORA2BTSHR
SCHEMBL29762115 0.91 TSHR (0.75) ADORA3ADORA2AADORA1ADORA2BTSHR
SCHEMBL29073576 0.91 TSHR (0.75) ADORA3ADORA2AADORA1ADORA2BTSHR
SCHEMBL24601275 0.91 TSHR (0.75) ADORA3ADORA2AADORA1ADORA2BTSHR
SCHEMBL29073581 0.91 TSHR (0.75) ADORA3ADORA2AADORA1ADORA2BTSHR
SCHEMBL24601412 0.89 ADORA3 (0.79) ADORA3ADORA2AADORA1ADORA2BTSHR
SCHEMBL29073604 0.89 ADORA3 (0.79) ADORA3ADORA2AADORA1ADORA2BTSHR
SCHEMBL29762267 0.89 ADORA3 (0.79) ADORA3ADORA2AADORA1ADORA2BTSHR
SCHEMBL29073599 0.89 ADORA3 (0.79) ADORA3ADORA2AADORA1ADORA2BTSHR
SCHEMBL29762088 0.87 ADORA3 (0.70) ADORA3ADORA2AADORA1ADORA2BTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240116975-A1 ADENOSINE A3 RECEPTOR AGONISTS, PREPARATION METHODS AND USES THEREOF ZHEJIANG VIMGREEN PHARMACEUTICALS, LTD. (CN) 2024-04-11 US claimed
EP-4273153-A1 ADENOSINE A3 RECEPTOR AGONISTS, PREPARATION METHODS AND USES THEREOF Zhejiang Vimgreen Pharmaceuticals, Ltd (CN) 2023-11-08 EP claimed
US-20240116975-A1 ADENOSINE A3 RECEPTOR AGONISTS, PREPARATION METHODS AND USES THEREOF ZHEJIANG VIMGREEN PHARMACEUTICALS, LTD. (CN) 2024-04-11 US disclosed
EP-4273153-A1 ADENOSINE A3 RECEPTOR AGONISTS, PREPARATION METHODS AND USES THEREOF Zhejiang Vimgreen Pharmaceuticals, Ltd (CN) 2023-11-08 EP disclosed
WO-2022143740-A1 ADENOSINE A3 RECEPTOR AGONIST, PREPARATION METHOD THEREFOR, AND USE THEREOF 浙江春禾医药科技有限公司 2022-07-07 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 (1 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-20240116975-A1 ADENOSINE A3 RECEPTOR AGONISTS, PREPARATION METHODS AND USES THEREOF ADORA3, ADORA2A, ADORA2B ADORA3 1/4885ADORA2A 2/4885ADORA1 4/4885

“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.