SCHEMBL1393632

SCHEMBL1393632

O=C1NCCn2c1cc1ccccc12

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ RPS6KA3 P51812 8/20 0.53
▸ PARP1 P09874 4/20 0.52
▸ MAPKAPK2 P49137 2/20 0.49
▸ RPS6KA2 Q15349 6/20 0.49
▸ HRH3 Q9Y5N1 4/20 0.49
▸ HTR2A P28223 2/20 0.49
▸ HTR2C P28335 2/20 0.49
▸ CYP2D6 P10635 1/20 0.48

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
SCHEMBL30172384 1.00 RPS6KA3 (0.53) RPS6KA3PARP1MAPKAPK2RPS6KA2HRH3
SCHEMBL30622473 0.90 RPS6KA3 (0.65) RPS6KA3MAPKAPK2RPS6KA2
SCHEMBL28028081 0.90 RPS6KA3 (0.65) RPS6KA3MAPKAPK2RPS6KA2
SCHEMBL7396812 0.83 RPS6KA3 (0.43) RPS6KA3PARP1RPS6KA2HRH3HTR2A
SCHEMBL24187362 0.80 RPS6KA2 (0.56) RPS6KA3PARP1MAPKAPK2RPS6KA2HRH3
SCHEMBL19252882 0.80 RPS6KA3 (0.56) RPS6KA3MAPKAPK2RPS6KA2HRH3CYP2D6
SCHEMBL2160684 0.80 HRH3 (0.54) RPS6KA3PARP1MAPKAPK2RPS6KA2HRH3
SCHEMBL38652559 0.80 HRH3 (0.52) RPS6KA3PARP1MAPKAPK2RPS6KA2HRH3
SCHEMBL30967663 0.80 RPS6KA3 (0.52) RPS6KA3PARP1MAPKAPK2RPS6KA2HRH3
SCHEMBL19187485 0.80 HRH3 (0.52) RPS6KA3PARP1MAPKAPK2RPS6KA2HRH3

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 84 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080226718-A1 Indole and Azaindole Derivatives For the Treatment of Inflammatory and Autoimmune Diseases BRANE DISCOVERY S.R.L (IT) 2008-09-18 — — US claimed
EP-1960401-A1 TRICYCLIC AMIDE DERIVATIVES USEFUL FOR TREATING OBESITY F.HOFFMANN-LA ROCHE AG (CH) 2008-08-27 — — EP claimed
US-20070248672-A1 Indole and Azaindole Derivatives with Antitumor Action NIKEM RESEARCH S.R.L. (IT) 2007-10-25 — — US claimed
WO-2007065820-A1 TRICYCLIC AMIDE DERIVATIVES USEFUL FOR TREATING OBESITY F. HOFFMANN-LA ROCHE AG (CH) 2007-06-14 — — WO claimed
EP-1750687-A2 INDOLE AND AZAINDOLE DERIVATIVES WITH ANTITUMOR ACTION NIKEM RESEARCH S.R.L. (IT) 2007-02-14 — — EP claimed
WO-2005105213-A2 INDOLE AND AZAINDOLE DERIVATIVES WITH ANTITUMOR ACTION NIKEM RESEARCH S.R.L. (IT) 2005-11-10 — — WO claimed
US-12144816-B2 Substituted indole Mcl-1 inhibitors VANDERBILT UNIVERSITY (US) 2024-11-19 — — US disclosed
CN-117510495-A Pyridazine compounds for inhibiting NLRP3 万特斯治疗美国公司 2024-02-06 — — CN disclosed
CN-117500792-A Pyridazine compounds for inhibiting NLRP3 万特斯治疗美国公司 2024-02-02 — — CN disclosed
CN-112088157-B Aryl-bipyridylamine derivatives as phosphatidylinositol phosphokinase inhibitors 拉文纳制药公司 2023-12-26 — — CN disclosed
EP-4292662-A2 SUBSTITUTED INDOLE MCL-1 INHIBITORS Vanderbilt University (US) 2023-12-20 — — EP disclosed
US-20230330099-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS VANDERBILT UNIVERSITY 2023-10-19 — — US disclosed
CN-110621675-B Tricyclic compounds useful for the treatment of proliferative diseases 阿古诺治疗有限公司 2023-09-19 — — CN disclosed
US-20090238761-A1 Novel Aryl Piperazine Derivatives With Medical Utility UNIVERSITA DEGLI STUDI DI SIENA (IT) 2009-09-24 — — US disclosed
US-20080226718-A1 Indole and Azaindole Derivatives For the Treatment of Inflammatory and Autoimmune Diseases BRANE DISCOVERY S.R.L (IT) 2008-09-18 — — US disclosed
EP-1945305-A2 INDOLE AND AZAINDOLE DERIVATIVES FOR THE TREATMENT OF INFLAMMATORY AND AUTOIMMUNE DISEASES BRANE DISCOVERY S.R.L. (IT) 2008-07-23 — — EP disclosed
US-20070248672-A1 Indole and Azaindole Derivatives with Antitumor Action NIKEM RESEARCH S.R.L. (IT) 2007-10-25 — — US disclosed
WO-2007048847-A2 INDOLE AND AZAINDOLE DERIVATIVES FOR THE TREATMENT OF INFLAMMATORY AND AUTOIMMUNE DISEASES NIKEM RESEARCH S.R.L. (IT) 2007-05-03 — — WO disclosed
EP-1750687-A2 INDOLE AND AZAINDOLE DERIVATIVES WITH ANTITUMOR ACTION NIKEM RESEARCH S.R.L. (IT) 2007-02-14 — — EP disclosed
WO-2005105213-A2 INDOLE AND AZAINDOLE DERIVATIVES WITH ANTITUMOR ACTION NIKEM RESEARCH S.R.L. (IT) 2005-11-10 — — 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 (5 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-20070248672-A1 Indole and Azaindole Derivatives with Antitumor Action IDO1, IDO2, INMT RPS6KA3 1250/4885PARP1 426/4885MAPKAPK2 2539/4885
US-12144816-B2 Substituted indole Mcl-1 inhibitors MCL1, BCL2L1, BCL9 RPS6KA3 1180/4885PARP1 230/4885MAPKAPK2 909/4885
US-20230330099-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS MCL1, BCL2L1, BCL9 RPS6KA3 1180/4885PARP1 230/4885MAPKAPK2 909/4885
US-20080226718-A1 Indole and Azaindole Derivatives For the Treatment of Inflammatory and Autoimmune Diseases IDO1, IDO2, INMT RPS6KA3 954/4885PARP1 1883/4885MAPKAPK2 3875/4885
US-20090238761-A1 Novel Aryl Piperazine Derivatives With Medical Utility HTR2C, HTR2A, DRD2 RPS6KA3 1240/4885PARP1 3197/4885MAPKAPK2 1134/4885

“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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