SCHEMBL30009923

SCHEMBL30009923

COCCOc1ccc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NC3CC3)c2n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 20/20 1.00
JAK2 O60674 19/20 1.00
JAK1 P23458 1/20 0.69

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
SCHEMBL1082852 1.00 NTRK1 (1.00) NTRK1JAK2JAK1
SCHEMBL1082853 1.00 NTRK1 (1.00) NTRK1JAK2JAK1
SCHEMBL2694236 0.92 NTRK1 (0.85) NTRK1JAK2
SCHEMBL2694238 0.92 NTRK1 (0.85) NTRK1JAK2
SCHEMBL29794676 0.91 NTRK1 (0.84) NTRK1JAK2JAK1
SCHEMBL1024691 0.91 NTRK1 (0.84) NTRK1JAK2JAK1
SCHEMBL1024689 0.91 NTRK1 (0.84) NTRK1JAK2JAK1
SCHEMBL950406 0.91 NTRK1 (0.88) NTRK1JAK2
SCHEMBL950408 0.91 NTRK1 (0.88) NTRK1JAK2
SCHEMBL12944299 0.90 NTRK1 (0.88) NTRK1JAK2

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
EP-4041259-A1 FEEDER-BASED AND FEEDER-FREE STEM CELL CULTURE SYSTEMS FOR STRATIFIED EPITHELIAL STEM CELLS, AND USES RELATED THERETO University of Houston System (US) 2022-08-17 EP disclosed