SCHEMBL31243045

SCHEMBL31243045

Cc1cc2c(cnn2C2CCCCO2)c(-c2nc3c4c(nc(OC[C@@]56CCCN5C[C@H](F)C6)nc4c2F)N(C(C)c2cccnc2N)CCO3)c1C

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KRAS P01116 14/20 0.46
MAPK3 P27361 6/20 0.42
MAPK1 P28482 6/20 0.42

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
SCHEMBL31526935 0.94 KRAS (0.45) KRASMAPK3MAPK1
SCHEMBL31243078 0.89 KRAS (0.52) KRASMAPK3MAPK1
SCHEMBL31526978 0.86 KRAS (0.47) KRASMAPK3MAPK1
SCHEMBL31527436 0.86 KRAS (0.41) KRASMAPK3MAPK1
SCHEMBL31243091 0.85 ATR (0.34)
SCHEMBL30873335 0.85 KRAS (0.47) KRASMAPK3MAPK1
SCHEMBL29321588 0.85 KRAS (0.47) KRASMAPK3MAPK1
SCHEMBL29323624 0.85 KRAS (0.47) KRASMAPK3MAPK1
SCHEMBL31527104 0.85 KRAS (0.47) KRASMAPK3MAPK1
SCHEMBL31243114 0.84 ATR (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4713330-A1 TRICYCLIC COMPOUNDS AND USES THEREOF HUTCHMED Limited (CN) 2026-03-25 EP disclosed
WO-2024235286-A1 TRICYCLIC COMPOUNDS AND USES THEREOF HUTCHMED LIMITED (CN) 2024-11-21 WO disclosed