SCHEMBL31723371

SCHEMBL31723371

COC(C)(C)Cn1cnc2ccc(Sc3cnc(N4CCC5(CC4)Cc4ncsc4[C@H]5N)cn3)c(Cl)c2c1=O

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 20/20 0.46
KCNH2 Q12809 4/20 0.46
MAPK3 P27361 5/20 0.37
MAPK1 P28482 5/20 0.37

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
SCHEMBL31723378 0.94 PTPN11 (0.48) PTPN11KCNH2MAPK3MAPK1
SCHEMBL24879142 0.93 PTPN11 (0.47) PTPN11KCNH2MAPK3MAPK1
SCHEMBL24879312 0.93 PTPN11 (0.47) PTPN11KCNH2MAPK3MAPK1
SCHEMBL24878926 0.93 PTPN11 (0.47) PTPN11KCNH2MAPK3MAPK1
SCHEMBL31723370 0.91 PTPN11 (0.51) PTPN11KCNH2MAPK3MAPK1
SCHEMBL31723344 0.90 PTPN11 (0.46) PTPN11KCNH2MAPK3MAPK1
SCHEMBL24879117 0.90 PTPN11 (0.47) PTPN11KCNH2MAPK3MAPK1
SCHEMBL30111087 0.90 PTPN11 (0.47) PTPN11KCNH2MAPK3MAPK1
SCHEMBL30987359 0.87 PTPN11 (0.51) PTPN11KCNH2MAPK3MAPK1
SCHEMBL31723358 0.86 PTPN11 (0.51) PTPN11KCNH2MAPK3MAPK1

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