SCHEMBL8017443

SCHEMBL8017443

CCOC(=O)c1nc(CC)cn1C1Cc2c(CP(=O)(OCC)OCC)cccc2C1=O

nearest known ligand 0.31

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 1/20 0.31
FLT1 P17948 1/20 0.31
FGFR3 P22607 1/20 0.31
ALDH1A1 P00352 3/20 0.31
KDM4E B2RXH2 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.30
BCL2 P10415 1/20 0.30
CYP1A2 P05177 1/20 0.30
GAA P10253 1/20 0.30
MAOA P21397 1/20 0.30
MAOB P27338 1/20 0.30
LMNA P02545 1/20 0.30

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
SCHEMBL8011792 0.90 GAA (0.36) ALDH1A1KDM4ECYP1A2GAA
SCHEMBL8020015 0.89 P2RX7 (0.33) ALDH1A1GAA
SCHEMBL8011799 0.89 CYP1A2 (0.32) ALDH1A1SMN1; SMN2CYP1A2GAALMNA
SCHEMBL7824847 0.82 ALDH1A1 (0.33) FGFR1FLT1FGFR3ALDH1A1GAA
SCHEMBL7823416 0.81
SCHEMBL8013600 0.81 ALDH1A1 (0.36) FGFR1FLT1FGFR3ALDH1A1KDM4E
SCHEMBL8090703 0.79 GAA (0.33) ALDH1A1GAA
SCHEMBL7845523 0.77 ALDH1A1 (0.34) ALDH1A1SMN1; SMN2CYP1A2GAALMNA
SCHEMBL8099222 0.76 GAA (0.38) ALDH1A1KDM4ECYP1A2GAA
SCHEMBL8013343 0.76 GAA (0.38) ALDH1A1KDM4ESMN1; SMN2CYP1A2GAA

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
US-6100264-A 5H, 10H-imidazo [1,2-A] indeno [1,2-E] pyrazin-4-one derivatives, their preparation, their intermediates and medicaments containing them RHONE-POULENC RORER, S.A. (FR) 2000-08-08 US disclosed