SCHEMBL19441024

SCHEMBL19441024

CCc1cc2c(=O)c3c4ccc(C)cc4[nH]c3n(C(C)C)c2c(F)c1C1CCN(C)CC1

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 20/20 0.64
DAPK3 O43293 1/20 0.48
INSR P06213 1/20 0.48
INSRR P14616 1/20 0.48
LTK P29376 1/20 0.48
CLK1 P49759 1/20 0.48
DAPK1 P53355 1/20 0.48
MERTK Q12866 1/20 0.48
DAPK2 Q9UIK4 1/20 0.48

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
SCHEMBL18589178 0.93 ALK (0.64) ALKDAPK3INSRINSRRLTK
SCHEMBL18589101 0.91 ALK (0.68) ALKDAPK3INSRINSRRLTK
SCHEMBL18589138 0.90 ALK (0.80) ALKDAPK3INSRINSRRLTK
SCHEMBL19441027 0.89 ALK (0.56) ALKDAPK3INSRINSRRLTK
SCHEMBL18589045 0.89 ALK (0.56) ALKDAPK3INSRINSRRLTK
SCHEMBL19441025 0.88 ALK (0.68) ALKDAPK3INSRINSRRLTK
SCHEMBL18589097 0.88 ALK (0.82) ALKDAPK3INSRINSRRLTK
SCHEMBL18589202 0.86 ALK (0.66) ALKDAPK3INSRINSRRLTK
SCHEMBL18589070 0.84 ALK (0.78) ALKDAPK3INSRINSRRLTK
SCHEMBL17054322 0.83 ALK (0.80) ALKDAPK3INSRINSRRLTK

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
US-9783539-B2 Indoloquinolone compounds as anaplastic lymphoma kinase (ALK) inhibitors JIANGSU ASCENTAGE BIOMED DEVELOPMENT INC. (CN) 2017-10-10 US disclosed