SCHEMBL18176360

SCHEMBL18176360

C[C@H](c1ccccc1)N(C)c1nnc2cc(-c3ncnc4[nH]ncc34)ccc2n1

nearest known ligand 0.79

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
RPS6KB1 P23443 20/20 0.79

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
Hydrochloric Acid SCHEMBL18171888 0.99 RPS6KB1 (0.78) RPS6KB1
SCHEMBL20593797 0.89 RPS6KB1 (1.00) RPS6KB1
SCHEMBL20593800 0.89 RPS6KB1 (1.00) RPS6KB1
Hydrochloric Acid SCHEMBL23289965 0.88 RPS6KB1 (0.98) RPS6KB1
Hydrochloric Acid SCHEMBL23289964 0.88 RPS6KB1 (0.98) RPS6KB1
SCHEMBL18176290 0.86 RPS6KB1 (0.72) RPS6KB1
SCHEMBL18176396 0.86 RPS6KB1 (0.72) RPS6KB1
SCHEMBL18176363 0.82 RPS6KB1 (0.79) RPS6KB1
SCHEMBL18176552 0.81 RPS6KB1 (0.77) RPS6KB1
Hydrochloric Acid SCHEMBL18171858 0.80 RPS6KB1 (0.76) RPS6KB1

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
WO-2016170163-A1 SUBSTITUTED QUINOXALINES AND BENZOTRIAZINE P70S6 KINASE INHIBITORS SENTINEL ONCOLOGY LIMITED (GB) 2016-10-27 WO disclosed