SCHEMBL20909288

SCHEMBL20909288

OCc1nc(Sc2ccnc(N3CC(O)C3)c2Cl)cnc1N1CCC2(CCOC2)CC1

nearest known ligand 0.55

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 20/20 0.55

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
SCHEMBL20909438 0.91 PTPN11 (0.54) PTPN11
SCHEMBL24151308 0.90 PTPN11 (0.52) PTPN11
SCHEMBL20909327 0.89 PTPN11 (0.53) PTPN11
SCHEMBL20909300 0.86 PTPN11 (0.71) PTPN11
SCHEMBL20909299 0.86 PTPN11 (0.57) PTPN11
SCHEMBL20909324 0.86 PTPN11 (0.57) PTPN11
SCHEMBL19785615 0.85 PTPN11 (0.56) PTPN11
SCHEMBL24151067 0.85 PTPN11 (0.52) PTPN11
SCHEMBL26428946 0.84 PTPN11 (0.51) PTPN11
SCHEMBL20909292 0.83 PTPN11 (0.53) 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-2019075265-A1 PYRIDINE, PYRAZINE, AND TRIAZINE COMPOUNDS AS ALLOSTERIC SHP2 INHIBITORS Revolution Medicines, Inc. (US) 2019-04-18 WO disclosed