SCHEMBL23998512

SCHEMBL23998512

CSc1nc2cc(-c3ccco3)nn2c(=O)[nH]1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ADORA3 P0DMS8 3/20 0.51
▸ PARP1 P09874 1/20 0.46
▸ ABCB1 P08183 2/20 0.45
▸ FUBP1 Q96AE4 1/20 0.41
▸ MEN1 O00255 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ ABCG2 Q9UNQ0 1/20 0.40
▸ DPP4 P27487 1/20 0.39
▸ CDK4 P11802 1/20 0.39
▸ CCND1 P24385 1/20 0.39
▸ P2RY6 Q15077 1/20 0.39

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
SCHEMBL5457663 0.81 NPC1 (0.52) PARP1MEN1ALDH1A1KMT2AL3MBTL1
SCHEMBL18788145 0.76 GRM2 (0.46) ALDH1A1ABCG2
SCHEMBL18788152 0.73 USP2 (0.57) ALDH1A1KMT2A
SCHEMBL24693472 0.73 USP2 (0.40) ALDH1A1
SCHEMBL23998420 0.72 ABCB1 (0.49) ADORA3ABCB1FUBP1MEN1ALDH1A1
SCHEMBL23998523 0.69 PARP1 (0.58) ADORA3PARP1MEN1ALDH1A1KMT2A
SCHEMBL23447727 0.68 ALDH1A1 (0.63) ABCB1MEN1ALDH1A1ALOX15KMT2A
SCHEMBL13815718 0.67 DPP4 (0.49) ABCB1FUBP1MEN1ALDH1A1ALOX15
SCHEMBL11245104 0.66 ALDH1A1 (0.34) MEN1ALDH1A1ALOX15KMT2AL3MBTL1
SCHEMBL23998222 0.66 ALDH1A1 (0.43) ADORA3ABCB1MEN1ALDH1A1ALOX15

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
CN-122010947-A Antagonists of adenosine A2a receptors 阿道尔克斯治疗有限公司 2026-05-12 — — CN disclosed
US-20230203041-A1 ANTAGONISTS OF THE ADENOSINE A2A RECEPTOR JANSSEN PHARMACEUTICA NV (BE) 2023-06-29 — — US disclosed
US-20230203041-A1 ANTAGONISTS OF THE ADENOSINE A2A RECEPTOR JANSSEN PHARMACEUTICA NV (BE) 2023-06-29 — — US disclosed
CN-115996929-A Antagonists of adenosine A2a receptors 阿道尔克斯治疗有限公司 2023-04-21 — — CN disclosed
WO-2021224636-A1 ANTAGONISTS OF THE ADENOSINE A2A RECEPTOR AdoRx Therapeutics Limited (GB) 2021-11-11 — — 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-20230203041-A1 ANTAGONISTS OF THE ADENOSINE A2A RECEPTOR ADORA2A, ADORA1, ADORA3 ADORA3 3/4885PARP1 522/4885ABCB1 174/4885

“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.

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