SCHEMBL25366229

SCHEMBL25366229

Cc1ncnc2ccc(-c3sc(N)nc3-c3cccc(C#N)c3)cc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 4/20 0.56
CYP1A2 P05177 11/20 0.50
ALDH1A1 P00352 9/20 0.50
CYP3A4 P08684 9/20 0.50
CLK4 Q9HAZ1 8/20 0.50
USP2 O75604 4/20 0.45
HIF1A Q16665 4/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
HSD17B10 Q99714 8/20 0.45
LMNA P02545 5/20 0.45
CYP2C9 P11712 5/20 0.45
MAPK1 P28482 4/20 0.45
TSHR P16473 4/20 0.45
TP53 P04637 3/20 0.45
KDM4E B2RXH2 2/20 0.45
HPGD P15428 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
MAPT P10636 2/20 0.44

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
SCHEMBL30519914 1.00 MAP4K4 (0.56) MAP4K4CYP1A2ALDH1A1CYP3A4CLK4
SCHEMBL30520034 0.87 MAP4K4 (0.53) MAP4K4CYP1A2ALDH1A1CYP3A4CLK4
SCHEMBL30520132 0.87 MAP4K4 (0.53) MAP4K4CYP1A2ALDH1A1CYP3A4CLK4
SCHEMBL25369200 0.87 MAP4K4 (0.53) MAP4K4CYP1A2ALDH1A1CYP3A4CLK4
SCHEMBL25366781 0.87 MAP4K4 (0.53) MAP4K4CYP1A2ALDH1A1CYP3A4CLK4
SCHEMBL25365404 0.87 ALDH1A1 (0.47) MAP4K4CYP1A2ALDH1A1CYP3A4CLK4
SCHEMBL30520125 0.87 ALDH1A1 (0.47) MAP4K4CYP1A2ALDH1A1CYP3A4CLK4
SCHEMBL25367687 0.86 TGFBR1 (0.47) MAP4K4CYP1A2ALDH1A1CYP3A4CLK4
SCHEMBL30520035 0.86 TGFBR1 (0.47) MAP4K4CYP1A2ALDH1A1CYP3A4CLK4
SCHEMBL25367694 0.85 ALDH1A1 (0.46) MAP4K4CYP1A2ALDH1A1CYP3A4CLK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250243194-A1 ANTAGONIST OF ADENOSINE RECEPTORS JANSSEN PHARMACEUTICA NV (BE) 2025-07-31 US disclosed
EP-4469452-A1 ANTAGONIST OF ADENOSINE RECEPTORS Adorx therapeutics Limited (GB) 2024-12-04 EP disclosed
WO-2023144559-A1 ANTAGONIST OF ADENOSINE RECEPTORS AdoRx Therapeutics Limited (GB) 2023-08-03 WO disclosed
WO-2023144559-A1 ANTAGONIST OF ADENOSINE RECEPTORS AdoRx Therapeutics Limited (GB) 2023-08-03 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-20250243194-A1 ANTAGONIST OF ADENOSINE RECEPTORS ADORA2B, ADORA2A, ADORA1 MAP4K4 3782/4885CYP1A2 403/4885ALDH1A1 637/4885

“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.