SCHEMBL31723376

SCHEMBL31723376

CC1(CN)CCN(c2cnc(Sc3ccc4ncn(Cc5ccccc5)c(=O)c4c3Cl)c(N)n2)CC1

nearest known ligand 0.61

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 20/20 0.61
KCNH2 Q12809 4/20 0.61
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
SCHEMBL24878908 0.87 PTPN11 (0.48) PTPN11KCNH2MAPK3MAPK1
SCHEMBL31723383 0.85 PTPN11 (0.63) PTPN11KCNH2MAPK3MAPK1
SCHEMBL27453046 0.81 PTPN11 (0.47) PTPN11MAPK3MAPK1
SCHEMBL27453838 0.79 PTPN11 (0.44) PTPN11KCNH2MAPK3MAPK1
SCHEMBL27453840 0.79 PTPN11 (0.45) PTPN11KCNH2MAPK3MAPK1
SCHEMBL27240712 0.78 PTPN11 (0.44) PTPN11KCNH2MAPK3MAPK1
SCHEMBL27216092 0.78 PTPN11 (0.43) PTPN11KCNH2MAPK3MAPK1
SCHEMBL29281493 0.77 PTPN11 (0.48) PTPN11
SCHEMBL16915558 0.77 PTPN11 (1.00) PTPN11KCNH2
SCHEMBL16926370 0.77 PTPN11 (1.00) PTPN11KCNH2

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