SCHEMBL8445448

SCHEMBL8445448

Cc1ncc(CO)c(N)n1.[NaH].[NaH].[NaH]

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.59
TKT P29401 5/20 0.50
HSP90AA1 P07900 1/20 0.48
KDM4E B2RXH2 1/20 0.45
ALDH1A1 P00352 1/20 0.44

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
SCHEMBL479344 0.98 LMNA (0.61) LMNATKTHSP90AA1KDM4EALDH1A1
Hydrochloric Acid SCHEMBL6520994 0.96 LMNA (0.59) LMNATKTHSP90AA1KDM4EALDH1A1
Phosphoric Acid SCHEMBL851329 0.89 LMNA (0.53) LMNATKTHSP90AA1
Phosphoric Acid SCHEMBL1533803 0.89 LMNA (0.53) LMNATKTHSP90AA1
Pyrophosphoric Acid SCHEMBL851327 0.84 LMNA (0.51) LMNATKT
Pyrazole SCHEMBL4017447 0.80 LMNA (0.48) LMNATKTHSP90AA1KDM4E
SCHEMBL23748348 0.79 LMNA (0.63) LMNATKTHSP90AA1KDM4EALDH1A1
SCHEMBL12346332 0.79 LMNA (0.63) LMNATKTKDM4EALDH1A1
SCHEMBL29895545 0.79 LMNA (0.63) LMNATKTHSP90AA1KDM4EALDH1A1
SCHEMBL478879 0.79 LMNA (0.63) LMNATKTHSP90AA1KDM4EALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5958387-A COPOLYMER OF SILOXANE AND HYDROLYZED OR UNHYDROLYZED PROTEIN, OR DIMETHICONE COPOLYOLS AND THEIR DERIVATIVES SOLUBILIZED IN AQUEOUS PHASE L'OREAL (FR) 1999-09-28 US disclosed
US-5626853-A Aqueous make-up gel containing organopolysiloxane L'OREAL (FR) 1997-05-06 US disclosed