SCHEMBL22975291

SCHEMBL22975291

COc1cccc(CN2C(=O)[C@]3(CC(=O)Nc4c3nnn4[C@@H](C)c3ccc(Cl)cc3)c3cc(Cl)ccc32)c1

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PTGDR2 Q9Y5Y4 16/20 0.52
▸ SCN9A Q15858 2/20 0.44
▸ TP53 P04637 1/20 0.38
▸ MAPT P10636 1/20 0.38

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
SCHEMBL22975295 1.00 PTGDR2 (0.52) PTGDR2SCN9ATP53MAPT
SCHEMBL22975274 0.93 PTGDR2 (0.43) PTGDR2SCN9A
SCHEMBL22975275 0.93 PTGDR2 (0.43) PTGDR2SCN9A
SCHEMBL22975305 0.91 PTGDR2 (0.49) PTGDR2TP53MAPT
SCHEMBL22975308 0.91 PTGDR2 (0.49) PTGDR2TP53MAPT
SCHEMBL22975249 0.90 PTGDR2 (0.44) PTGDR2TP53MAPT
SCHEMBL22975252 0.90 PTGDR2 (0.44) PTGDR2TP53MAPT
SCHEMBL22975267 0.90 PTGDR2 (0.42) PTGDR2TP53MAPT
SCHEMBL22975270 0.90 PTGDR2 (0.42) PTGDR2TP53MAPT
SCHEMBL22975302 0.87 PTGDR2 (0.41) PTGDR2TP53MAPT

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-12077540-B2 Substituted 4,6-dihydrospiro[[1,2,3]triazolo[4,5-b]pyridine-7,3'-indoline]-2',5(3H)-dione analogues THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2024-09-03 — — US disclosed
US-20230056205-A1 SUBSTITUTED 4,6-DIHYDROSPIRO[[1,2,3]TRIAZOLO[4,5-B]PYRIDINE-7,3'-INDOLINE]-2',5(3H)-DIONE ANALOGUES THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2023-02-23 — — US disclosed
US-11407752-B2 Substituted 4,6-dihydrospiro[[1,2,3]triazolo[4,5-b]pyridine-7,3′-indoline]-2′,5(3H)-dione analogues THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2022-08-09 — — US disclosed
US-20210047329-A1 SUBSTITUTED 4,6-DIHYDROSPIRO[[1,2,3]TRIAZOLO[4,5-B]PYRIDINE-7,3'-INDOLINE]-2',5(3H)-DIONE ANALOGUES THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2021-02-18 — — US 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 (4 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-20210047329-A1 SUBSTITUTED 4,6-DIHYDROSPIRO[[1,2,3]TRIAZOLO[4,5-B]PYRIDINE-7,3'-INDOLINE]-2',5(3H)-DIONE ANALOGUES DHPS, QDPR, HTR5A PTGDR2 393/4885SCN9A 3085/4885TP53 1672/4885
US-20230056205-A1 SUBSTITUTED 4,6-DIHYDROSPIRO[[1,2,3]TRIAZOLO[4,5-B]PYRIDINE-7,3'-INDOLINE]-2',5(3H)-DIONE ANALOGUES DHPS, QDPR, HTR5A PTGDR2 386/4885SCN9A 3109/4885TP53 1646/4885
US-11407752-B2 Substituted 4,6-dihydrospiro[[1,2,3]triazolo[4,5-b]pyridine-7,3′-indoline]-2′,5(3H)-dione analogues DHPS, HTR5A, QDPR PTGDR2 405/4885SCN9A 3055/4885TP53 1751/4885
US-12077540-B2 Substituted 4,6-dihydrospiro[[1,2,3]triazolo[4,5-b]pyridine-7,3'-indoline]-2',5(3H)-dione analogues DHPS, QDPR, HTR5A PTGDR2 393/4885SCN9A 3085/4885TP53 1672/4885

“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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