SCHEMBL24879362

SCHEMBL24879362

CC1OCC2(CCN(c3cnc(Sc4ccc5ncn(CCN6CCCC6)c(=O)c5c4Cl)cn3)CC2)C1N

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 20/20 0.53
MAPK3 P27361 1/20 0.49
MAPK1 P28482 1/20 0.49

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
SCHEMBL24878746 1.00 PTPN11 (0.53) PTPN11MAPK3MAPK1
SCHEMBL24878865 0.92 PTPN11 (0.55) PTPN11MAPK3MAPK1
SCHEMBL27453103 0.91 PTPN11 (0.54) PTPN11MAPK3MAPK1
SCHEMBL24878947 0.90 PTPN11 (0.53) PTPN11MAPK3MAPK1
SCHEMBL24879308 0.90 PTPN11 (0.53) PTPN11MAPK3MAPK1
SCHEMBL27453094 0.90 PTPN11 (0.54) PTPN11MAPK3MAPK1
SCHEMBL24878971 0.90 PTPN11 (0.53) PTPN11MAPK3MAPK1
SCHEMBL24879165 0.90 PTPN11 (0.54) PTPN11MAPK3MAPK1
SCHEMBL24878881 0.90 PTPN11 (0.53) PTPN11MAPK3MAPK1
SCHEMBL24878900 0.90 PTPN11 (0.55) PTPN11MAPK3MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023282702-A1 SHP2 INHIBITOR AND USE THEREOF 주식회사 카나프테라퓨틱스 2023-01-12 WO disclosed