SCHEMBL22110704

SCHEMBL22110704

COC(CO)(CCn1ccc(N)nc1=O)C(C)F

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 4/20 0.44
SLC22A6 Q4U2R8 1/20 0.43
EP300 Q09472 10/20 0.35
MAPT P10636 1/20 0.34
PDE4D Q08499 1/20 0.32
PDE3A Q14432 1/20 0.32
SLC29A1 Q99808 1/20 0.32
LMNA P02545 1/20 0.32
THRB P10828 1/20 0.32
MTOR P42345 1/20 0.32
MDM2 Q00987 1/20 0.32
NCOA1 Q15788 1/20 0.32
NCOA3 Q9Y6Q9 1/20 0.32

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
SCHEMBL10436383 0.81 FGFR1 (0.43) FGFR1SLC22A6EP300MAPTPDE3A
SCHEMBL18687280 0.80 FGFR1 (0.42) FGFR1SLC22A6EP300MAPTPDE3A
SCHEMBL20117260 0.77 FGFR1 (0.40) FGFR1SLC22A6EP300MAPTLMNA
SCHEMBL10436367 0.77 FGFR1 (0.42) FGFR1SLC22A6EP300MAPTPDE4D
SCHEMBL18687555 0.76 FGFR1 (0.39) FGFR1SLC22A6EP300MAPTLMNA
SCHEMBL10436523 0.75 FGFR1 (0.43) FGFR1SLC22A6EP300MAPTPDE4D
SCHEMBL19590385 0.75 FGFR1 (0.35) FGFR1SLC22A6MAPTPDE4DPDE3A
SCHEMBL2152990 0.74 FGFR1 (0.52) FGFR1SLC22A6EP300MAPTLMNA
SCHEMBL19493433 0.74 FGFR1 (0.52) FGFR1SLC22A6EP300MAPTLMNA
SCHEMBL19993637 0.73 FGFR1 (0.36) FGFR1SLC22A6MAPTPDE4DPDE3A

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-3183261-B1 2'-CHLORO AMINOPYRIMIDINONE AND PYRIMIDINE DIONE NUCLEOSIDES GILEAD SCIENCES INC (US) 2020-06-17 EP disclosed