SCHEMBL10567181

SCHEMBL10567181

CCC1(C(=O)O)CCCCCCCCCCC1=O

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 1/20 0.36
GRIN3B O60391 1/20 0.36
GRIN1 Q05586 1/20 0.36
GRIN2A Q12879 1/20 0.36
GRIN2B Q13224 1/20 0.36
GRIN2C Q14957 1/20 0.36
GRIN3A Q8TCU5 1/20 0.36
TSHR P16473 2/20 0.36
LMNA P02545 1/20 0.36
CYP2C19 P33261 1/20 0.34
CETP P11597 1/20 0.32
HTT P42858 1/20 0.31
CNR2 P34972 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL10572911 1.00 GRIN2D (0.36) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL6080049 1.00 GRIN2D (0.36) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL8378475 1.00 GRIN2D (0.36) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL561319 0.98 GRIN2D (0.37) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL1749522 0.92 CYP3A4 (0.32) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL1082424 0.84 CETP (0.33) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL8093611 0.83 GRIN2D (0.30) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL30020037 0.80 GRIN1 (0.36) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL11620033 0.79 CYP2C19 (0.31) CYP2C19
SCHEMBL6060737 0.78 SIRT2 (0.33) TSHRCYP2C19MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4814335-A Antiviral compounds BIOMEASURE, INCORPORATED (US) 1989-03-21 US disclosed
US-4625026-A 2-amino-4-oxo-tricyclicpyrimidines having antiviral activities against herpes simplex virus type II infections BIOMEASURE, INC. (US) 1986-11-25 US disclosed
EP-0123750-A1 Condensed amino pyrimidinones and their use in the treatment and prophylaxis of viral infections BIOMEASURE, INC. (US) 1984-11-07 EP disclosed