SCHEMBL28630458

SCHEMBL28630458

O=PCn1cc(-c2cnc3nnn(Cc4ccc5ncccc5c4)c3n2)cn1

nearest known ligand 0.78

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MET P08581 20/20 0.78
CYP2C9 P11712 1/20 0.78
PDE3B Q13370 1/20 0.78
PDE3A Q14432 1/20 0.78
PDE10A Q9Y233 1/20 0.78

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
SCHEMBL16324440 0.89 MET (0.80) METCYP2C9PDE3BPDE3APDE10A
SCHEMBL2573354 0.88 MET (1.00) METCYP2C9PDE3BPDE3APDE10A
Pf-04217903 SCHEMBL29394198 0.88 MET (1.00) METCYP2C9PDE3BPDE3APDE10A
Pf-04217903 SCHEMBL93550 0.88 MET (1.00) METCYP2C9PDE3BPDE3APDE10A
Pf-04217903 SCHEMBL29355971 0.88 MET (1.00) METCYP2C9PDE3BPDE3APDE10A
SCHEMBL2572767 0.88 MET (0.84) METCYP2C9PDE3BPDE3APDE10A
SCHEMBL22109301 0.87 MET (0.75) METCYP2C9PDE3BPDE3APDE10A
SCHEMBL30948876 0.87 MET (0.75) METCYP2C9PDE3BPDE3APDE10A
Pf-04217903 SCHEMBL1178807 0.87 MET (0.98) METCYP2C9PDE3BPDE3APDE10A
Pf-04217903 SCHEMBL1178245 0.85 MET (0.92) METCYP2C9PDE3BPDE3APDE10A

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-113412112-A Organophosphorus substituted compounds as c-MET inhibitors and therapeutic uses thereof 贝达医药公司 2021-09-17 CN disclosed