SCHEMBL4748766

SCHEMBL4748766

NC1=NC(=O)[N]c2nc[nH]c21

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
POLB P06746 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31
ATIC P31939 1/20 0.31
PNP P00491 2/20 0.30
ABL1 P00519 1/20 0.30
RIN1 Q13671 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
SCHEMBL7011289 0.64 ATIC (0.36) ALDH1A1POLBRXFP1ATIC
SCHEMBL905427 0.62 PNP (0.31) ALDH1A1PNPABL1RIN1
SCHEMBL8012264 0.60
SCHEMBL4455591 0.57
SCHEMBL5165263 0.56 ALDH1A1 (0.44) ALDH1A1POLBRXFP1ATIC
SCHEMBL13735762 0.56 ALDH1A1 (0.65) ALDH1A1POLBRXFP1ATIC
SCHEMBL8011952 0.55 GDA (0.38) ALDH1A1POLBRXFP1ATIC
SCHEMBL5742205 0.54 ALDH1A1 (0.52) ALDH1A1POLBRXFP1ATICABL1
SCHEMBL14793621 0.54 HPGD (0.38) ALDH1A1POLB
SCHEMBL8009805 0.54 ATIC (0.34) ALDH1A1POLBRXFP1ATICPNP

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
WO-2008136842-A1 POLY( CARBONATE-CO-UREA) COPOLYMERS SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2008-11-13 WO disclosed