SCHEMBL31723339

SCHEMBL31723339

COC1(Cn2cnc3ccc(Sc4cnc(N5CCC6(CC5)CO[C@@H](C)[C@H]6N)cn4)c(Cl)c3c2=O)CC1

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 20/20 0.51
MAPK3 P27361 1/20 0.48
MAPK1 P28482 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
SCHEMBL27453103 0.90 PTPN11 (0.54) PTPN11MAPK3MAPK1
SCHEMBL27453094 0.90 PTPN11 (0.54) PTPN11MAPK3MAPK1
SCHEMBL24879146 0.90 PTPN11 (0.52) PTPN11MAPK3MAPK1
SCHEMBL24879100 0.88 PTPN11 (0.51) PTPN11MAPK3MAPK1
SCHEMBL30987302 0.88 PTPN11 (0.51) PTPN11MAPK3MAPK1
SCHEMBL24879156 0.88 PTPN11 (0.53) PTPN11MAPK3MAPK1
SCHEMBL30987300 0.88 PTPN11 (0.51) PTPN11MAPK3MAPK1
SCHEMBL24879474 0.88 PTPN11 (0.53) PTPN11MAPK3MAPK1
SCHEMBL24878865 0.88 PTPN11 (0.55) PTPN11MAPK3MAPK1
SCHEMBL31723348 0.88 PTPN11 (0.51) 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
EP-4647433-A1 SHP2 INHIBITOR AND USES THEREOF Kanaph Therapeutics Inc. (KR) 2025-11-12 EP disclosed