SCHEMBL7809165

SCHEMBL7809165

C[C@H]1CN(C(=O)OC(C)(C)C)CCN1c1ccc2c(c1)C(C)(C)c1[nH]c3cc(N)ccc3c1C2=O

nearest known ligand 0.55

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 20/20 0.55
KIT P10721 1/20 0.41
KDR P35968 1/20 0.41

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
SCHEMBL896920 0.89 ALK (0.68) ALKKITKDR
SCHEMBL896919 0.89 ALK (0.68) ALKKITKDR
SCHEMBL1755929 0.87 ALK (0.59) ALKKITKDR
SCHEMBL7808984 0.83 ALK (0.65) ALKKDR
SCHEMBL7807485 0.82 ALK (0.62) ALK
SCHEMBL1755847 0.80 ALK (0.78) ALKKITKDR
SCHEMBL7811634 0.80 ALK (0.62) ALK
SCHEMBL1755797 0.79 ALK (0.62) ALK
SCHEMBL7805237 0.79 ALK (0.55) ALKKITKDR
SCHEMBL7800549 0.78 ALK (0.55) ALKKDR

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-2441753-A1 TETRACYCLIC COMPOUND Chugai Seiyaku Kabushiki Kaisha (JP) 2012-04-18 EP disclosed
WO-2010143664-A1 TETRACYCLIC COMPOUND 中外製薬株式会社 (JP) 2010-12-16 WO disclosed