Sugi Predict

Sugi Predict / Compounds / SCHEMBL29869993

SCHEMBL29869993

SCHEMBL29869993

CC(c1ccc2ncc(-c3ccc(F)cc3)cc2c1)n1nnc2ncc(-c3cnn(C)c3)nc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MET P08581 20/20 1.00
▸ PDE4C Q08493 1/20 0.71
▸ PDE4D Q08499 1/20 0.71
▸ PDE3B Q13370 1/20 0.71
▸ PDE3A Q14432 1/20 0.71
▸ NQO2 P16083 1/20 0.59
▸ KIT P10721 1/20 0.58
▸ SRC P12931 1/20 0.58
▸ PDGFRA P16234 1/20 0.58
▸ AXL P30530 1/20 0.58
▸ KDR P35968 1/20 0.58
▸ MST1R Q04912 1/20 0.58

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
SCHEMBL29869924 0.93 MET (1.00) METPDE4CPDE4DPDE3BPDE3A
SCHEMBL29869947 0.88 MET (0.79) METPDE4CPDE4DPDE3BPDE3A
SCHEMBL29869874 0.85 MET (0.84) METPDE4CPDE4DPDE3BPDE3A
SCHEMBL29870142 0.84 MET (1.00) METPDE4CPDE4DPDE3BPDE3A
SCHEMBL29870098 0.84 MET (1.00) METPDE4CPDE4DPDE3BPDE3A
SCHEMBL2571767 0.83 MET (1.00) METPDE4CPDE4DPDE3BPDE3A
SCHEMBL2572042 0.83 MET (1.00) METPDE4CPDE4DPDE3BPDE3A
SCHEMBL29869833 0.83 MET (0.81) METPDE4CPDE4DPDE3BPDE3A
SCHEMBL2568394 0.83 MET (1.00) METPDE4CPDE4DPDE3BPDE3A
SCHEMBL29869997 0.83 MET (0.74) METPDE4CPDE4DPDE3BPDE3A

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-107312009-B Quinoline compound, preparation method, intermediate, pharmaceutical composition and application thereof 上海医药集团股份有限公司 2022-09-20 — — CN disclosed