SCHEMBL7807828

SCHEMBL7807828

CC1(C)c2cc(N3CCOCC3)ccc2C(=O)c2c1[nH]c1cc(N)ccc21

nearest known ligand 0.75

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 20/20 0.75
KIT P10721 2/20 0.63
KDR P35968 2/20 0.63

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
SCHEMBL7805461 0.91 ALK (0.78) ALKKITKDR
SCHEMBL1755799 0.91 ALK (0.73) ALKKITKDR
SCHEMBL7806045 0.89 ALK (0.65) ALKKITKDR
SCHEMBL1755745 0.89 ALK (0.62) ALKKITKDR
SCHEMBL7805398 0.87 ALK (0.77) ALKKITKDR
SCHEMBL7810184 0.87 ALK (0.75) ALKKITKDR
SCHEMBL7806105 0.87 ALK (0.77) ALKKITKDR
SCHEMBL7803004 0.86 ALK (0.75) ALKKITKDR
SCHEMBL7805433 0.86 ALK (0.75) ALKKITKDR
SCHEMBL896878 0.85 ALK (1.00) ALKKITKDR

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