SCHEMBL9936358

SCHEMBL9936358

OCc1cn2cc(Br)nc(Br)c2n1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PIK3R1 P27986 1/20 0.32
PIK3CA P42336 1/20 0.32
ADORA1 P30542 1/20 0.32
ADORA2A P29274 1/20 0.30

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
SCHEMBL9970947 0.77
SCHEMBL29155749 0.77 PIK3R1 (0.33) PIK3R1PIK3CA
SCHEMBL19629696 0.71 ADORA1 (0.34) ADORA1ADORA2A
SCHEMBL19736848 0.70 APP (0.46) PIK3R1PIK3CA
SCHEMBL19736855 0.70 RXFP1 (0.56) PIK3R1PIK3CA
SCHEMBL24033491 0.70 RXFP1 (0.36) PIK3R1PIK3CA
SCHEMBL20533633 0.69 MCHR1 (0.33)
SCHEMBL23320338 0.69 MAPK1 (0.40) PIK3R1PIK3CAADORA2A
SCHEMBL7314867 0.68 RXFP1 (0.40) PIK3R1PIK3CAADORA1ADORA2A
SCHEMBL24738962 0.67 PIK3R1 (0.33) PIK3R1PIK3CA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9284317-B2 Substituted imidazo[1,2-a]pyrazines as MPS-1 inhibitors BAYER INTELLECTUAL PROPERTY GMBH (DE) 2016-03-15 US disclosed
US-9284317-B2 Substituted imidazo[1,2-a]pyrazines as MPS-1 inhibitors BAYER INTELLECTUAL PROPERTY GMBH (DE) 2016-03-15 US disclosed
US-9212184-B2 6-thio-substituted imidazo[1,2-a]pyrazines as Mps-1 inhibitors BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-12-15 US disclosed
US-9212184-B2 6-thio-substituted imidazo[1,2-a]pyrazines as Mps-1 inhibitors BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-12-15 US disclosed
US-9212184-B2 6-thio-substituted imidazo[1,2-a]pyrazines as Mps-1 inhibitors BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-12-15 US disclosed
EP-2651944-B1 SUBSTITUTED 6-IMIDAZOPYRAZINES FOR USE AS MPS-1 AND TKK INHIBITORS IN THE TREATMENT OF HYPERPROLIFERATIVE DISORDERS BAYER IP GMBH (DE) 2015-09-23 EP disclosed
EP-2651944-B1 SUBSTITUTED 6-IMIDAZOPYRAZINES FOR USE AS MPS-1 AND TKK INHIBITORS IN THE TREATMENT OF HYPERPROLIFERATIVE DISORDERS BAYER IP GMBH (DE) 2015-09-23 EP disclosed
EP-2651946-B1 2-SUBSTITUTED IMIDAZOPYRAZINES FOR USE AS MPS-1 AND TKK INHIBITORS IN THE TREATMENT OF HYPERPROLIFERATIVE DISORDERS BAYER IP GMBH (DE) 2015-05-27 EP disclosed
EP-2651946-B1 2-SUBSTITUTED IMIDAZOPYRAZINES FOR USE AS MPS-1 AND TKK INHIBITORS IN THE TREATMENT OF HYPERPROLIFERATIVE DISORDERS BAYER IP GMBH (DE) 2015-05-27 EP disclosed
EP-2651947-B1 6-THIO-SUBSTITUTED IMIDAZOPYRAZINES FOR USE AS MPS-1 AND TKK INHIBITORS IN THE TREATMENT OF HYPERPROLIFERATIVE DISORDERS BAYER IP GMBH (DE) 2014-12-10 EP disclosed
EP-2651947-A1 6-THIO-SUBSTITUTED IMIDAZOPYRAZINES FOR USE AS MPS-1 AND TKK INHIBITORS IN THE TREATMENT OF HYPERPROLIFERATIVE DISORDERS Bayer Intellectual Property GmbH (DE) 2013-10-23 EP disclosed
EP-2651945-A1 6-SUBSTITUTED IMIDAZOPYRAZINES FOR USE AS MPS-1 AND TKK INHIBITORS IN THE TREATMENT OF HYPERPROLIFERATIVE DISORDERS Bayer Intellectual Property GmbH (DE) 2013-10-23 EP disclosed
US-20130267527-A1 SUBSTITUTED 6-IMIDAZOPYRAZINES FOR USE AS MPS-1 AND TKK INHIBITORS IN THE TREATMENT OF HYPERPROLIFERATIVE DISORDERS BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-10-10 US disclosed
US-20130267527-A1 SUBSTITUTED 6-IMIDAZOPYRAZINES FOR USE AS MPS-1 AND TKK INHIBITORS IN THE TREATMENT OF HYPERPROLIFERATIVE DISORDERS BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-10-10 US disclosed
US-20130267527-A1 SUBSTITUTED 6-IMIDAZOPYRAZINES FOR USE AS MPS-1 AND TKK INHIBITORS IN THE TREATMENT OF HYPERPROLIFERATIVE DISORDERS BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-10-10 US disclosed
WO-2012080234-A1 SUBSTITUTED 6-IMIDAZOPYRAZINES FOR USE AS MPS-1 AND TKK INHIBITORS IN THE TREATMENT OF HYPERPROLIFERATIVE DISORDERS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-06-21 WO disclosed
WO-2012080228-A1 6-THIO-SUBSTITUTED IMIDAZOPYRAZINES FOR USE AS MPS-1 AND TKK INHIBITORS IN THE TREATMENT OF HYPERPROLIFERATIVE DISORDERS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-06-21 WO disclosed
WO-2012080232-A1 2-SUBSTITUTED IMIDAZOPYRAZINES FOR USE AS MPS-1 AND TKK INHIBITORS IN THE TREATMENT OF HYPERPROLIFERATIVE DISORDERS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-06-21 WO disclosed
WO-2012080236-A1 6-SUBSTITUTED IMIDAZOPYRAZINES FOR USE AS MPS-1 AND TKK INHIBITORS IN THE TREATMENT OF HYPERPROLIFERATIVE DISORDERS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-06-21 WO disclosed
WO-2012080236-A1 6-SUBSTITUTED IMIDAZOPYRAZINES FOR USE AS MPS-1 AND TKK INHIBITORS IN THE TREATMENT OF HYPERPROLIFERATIVE DISORDERS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-06-21 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-20130267527-A1 SUBSTITUTED 6-IMIDAZOPYRAZINES FOR USE AS MPS-1 AND TKK INHIBITORS IN THE TREATMENT OF HYPERPROLIFERATIVE DISORDERS TK1, FLT1, RPS6KA1 PIK3R1 370/4885PIK3CA 29/4885ADORA1 1434/4885

“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.