SCHEMBL31085459

SCHEMBL31085459

CCOC(=O)c1cnn2ccc(N3CCCC3c3cccc(Cl)c3)nc12

nearest known ligand 0.62

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 19/20 0.62
JAK2 O60674 16/20 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
SCHEMBL31085446 1.00 NTRK1 (0.62) NTRK1JAK2
SCHEMBL31085442 0.90 NTRK1 (0.75) NTRK1JAK2
SCHEMBL461425 0.90 NTRK1 (0.75) NTRK1JAK2
SCHEMBL31085443 0.90 NTRK1 (0.75) NTRK1JAK2
SCHEMBL462298 0.90 NTRK1 (0.75) NTRK1JAK2
SCHEMBL29450153 0.88 NTRK1 (0.68) NTRK1JAK2
SCHEMBL29450132 0.88 NTRK1 (0.68) NTRK1JAK2
SCHEMBL461901 0.87 NTRK1 (0.71) NTRK1JAK2
SCHEMBL31085440 0.86 NTRK1 (0.63) NTRK1JAK2
SCHEMBL31085438 0.86 NTRK1 (0.63) 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
CN-114315899-B 3- (Aromatic ring imidazole) pyrazolopyrimidine derivative and application thereof 上海美迪西生物医药股份有限公司 2024-09-03 CN disclosed