SCHEMBL24151102

SCHEMBL24151102

COC(=O)c1nc(Sc2ccnc(N3CC(C(C)(C)O)C3)c2Cl)cnc1N1CCC2(CC1)CCC1(CC1)C2NC(=O)OC(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 20/20 0.41

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
SCHEMBL25808078 1.00 PTPN11 (0.41) PTPN11
SCHEMBL24151101 0.90 PTPN11 (0.53) PTPN11
SCHEMBL25808080 0.90 PTPN11 (0.53) PTPN11
SCHEMBL24152310 0.90 PTPN11 (0.40) PTPN11
SCHEMBL25801421 0.89 PTPN11 (0.45) PTPN11
SCHEMBL24151065 0.89 PTPN11 (0.47) PTPN11
SCHEMBL24151857 0.88 PTPN11 (0.46) PTPN11
SCHEMBL24152611 0.86 PTPN11 (0.36) PTPN11
SCHEMBL24151112 0.85 PTPN11 (0.36) PTPN11
SCHEMBL24151796 0.84 PTPN11 (0.36) PTPN11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4169913-A1 SUBSTITUTED PYRAZINE COMPOUND, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND USE THEREOF Sichuan Kelun-Biotech Biopharmaceutical Co., Ltd. (CN) 2023-04-26 EP disclosed
WO-2021259077-A1 SUBSTITUTED PYRAZINE COMPOUND, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND USE THEREOF 四川科伦博泰生物医药股份有限公司 2021-12-30 WO disclosed