SCHEMBL31723383

SCHEMBL31723383

C[C@@H]1OCC2(CCN(c3cnc(Sc4ccc5ncn(Cc6ccccc6)c(=O)c5c4Cl)c(N)n3)CC2)[C@@H]1N

nearest known ligand 0.63

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 20/20 0.63
MAPK3 P27361 1/20 0.52
MAPK1 P28482 1/20 0.52
KCNH2 Q12809 1/20 0.47

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
SCHEMBL24878822 0.89 PTPN11 (0.54) PTPN11MAPK3MAPK1
SCHEMBL24879261 0.88 PTPN11 (0.61) PTPN11MAPK3MAPK1
SCHEMBL31723368 0.87 PTPN11 (0.60) PTPN11MAPK3MAPK1
SCHEMBL31723376 0.85 PTPN11 (0.61) PTPN11MAPK3MAPK1KCNH2
SCHEMBL24878846 0.83 PTPN11 (0.54) PTPN11MAPK3MAPK1
SCHEMBL30111032 0.83 PTPN11 (0.53) PTPN11MAPK3MAPK1
SCHEMBL27216082 0.83 PTPN11 (0.53) PTPN11MAPK3MAPK1
SCHEMBL24878731 0.82 PTPN11 (0.50) PTPN11MAPK3MAPK1
SCHEMBL24878931 0.82 PTPN11 (0.51) PTPN11MAPK3MAPK1
SCHEMBL24878991 0.82 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