SCHEMBL20004108

SCHEMBL20004108

CC1(C)c2cc(OSN3CCOCC3)ccc2C(=O)c2c1[nH]c1cc(C#N)ccc21

nearest known ligand 0.70

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 20/20 0.70
KIT P10721 1/20 0.62
KDR P35968 1/20 0.62

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
SCHEMBL20004560 0.91 ALK (0.64) ALK
SCHEMBL20004179 0.85 ALK (0.77) ALK
SCHEMBL897415 0.85 ALK (0.73) ALKKITKDR
SCHEMBL897474 0.83 ALK (0.81) ALK
SCHEMBL897215 0.82 ALK (0.83) ALKKITKDR
SCHEMBL896878 0.82 ALK (1.00) ALKKITKDR
SCHEMBL20004104 0.81 ALK (0.73) ALK
SCHEMBL21613393 0.81 ALK (0.68) ALK
SCHEMBL897114 0.81 ALK (0.78) ALK
SCHEMBL897623 0.81 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3613729-A1 TETRACYCLIC COMPOUNDS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2020-02-26 EP disclosed
EP-3345903-B1 TETRACYCLIC COMPOUNDS CHUGAI PHARMACEUTICAL CO LTD (JP) 2019-10-09 EP disclosed
EP-3345903-A1 TETRACYCLIC COMPOUNDS Chugai Seiyaku Kabushiki Kaisha (JP) 2018-07-11 EP disclosed
EP-2975024-B1 TETRACYCLIC COMPOUNDS CHUGAI PHARMACEUTICAL CO LTD (JP) 2018-03-28 EP disclosed