SCHEMBL23217059

SCHEMBL23217059

C[C@H](Nc1ncc(-c2cc(C3CC3)n[nH]2)c(N)n1)c1ccc(F)cc1

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 16/20 0.52
RPS6KB1 P23443 1/20 0.41
JAK2 O60674 1/20 0.41
JAK3 P52333 1/20 0.41
IGF1R P08069 3/20 0.40
GPR55 Q9Y2T6 1/20 0.39

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
SCHEMBL30010123 1.00 NTRK1 (0.52) NTRK1RPS6KB1JAK2JAK3IGF1R
SCHEMBL4077928 0.90 NTRK1 (0.49) NTRK1RPS6KB1IGF1R
SCHEMBL4162039 0.84 NTRK1 (0.62) NTRK1JAK2JAK3IGF1R
SCHEMBL15209597 0.84 PAK1 (0.49) NTRK1IGF1R
SCHEMBL4072134 0.83 NTRK1 (0.48) NTRK1JAK2JAK3
SCHEMBL4071743 0.82 NTRK1 (0.47) NTRK1JAK2JAK3
SCHEMBL4074269 0.82 NTRK1 (0.49) NTRK1JAK2JAK3
SCHEMBL2511149 0.82 NTRK1 (0.41) NTRK1JAK2JAK3GPR55
SCHEMBL4491060 0.82 NTRK1 (0.41) NTRK1JAK2JAK3GPR55
SCHEMBL4074195 0.76 NTRK1 (0.69) NTRK1JAK2JAK3IGF1R

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-2021072238-A1 FEEDER-BASED AND FEEDER-FREE STEM CELL CULTURE SYSTEMS FOR STRATIFIED EPITHELIAL STEM CELLS, AND USES RELATED THERETO UNIVERSITY OF HOUSTON SYSTEM (US) 2021-04-15 WO disclosed