SCHEMBL7801220

SCHEMBL7801220

CC(NC(c1ccc(Cl)cc1)c1ccccc1Nc1c(O)c(=O)c1=O)c1cccc2ccccc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.38
MEN1 O00255 1/20 0.38
MAPT P10636 1/20 0.38
HTT P42858 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
CCR6 P51684 1/20 0.37
CXCL8 P10145 3/20 0.36
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
IDH1 O75874 1/20 0.35
TRPV1 Q8NER1 3/20 0.34
ALDH1A1 P00352 1/20 0.34
ACP3 P15309 1/20 0.34

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
Hydrochloric Acid SCHEMBL7802250 0.99 LMNA (0.37) LMNAMEN1MAPTHTTKMT2A
SCHEMBL7803619 0.90 MAOA (0.37) LMNAMEN1KMT2ACCR6GRIN2D
Hydrochloric Acid SCHEMBL7805326 0.89 MAOA (0.39) LMNAMEN1KMT2ACCR6GRIN2D
SCHEMBL7804119 0.86 CXCR2 (0.41) LMNAMEN1MAPTKMT2ACCR6
SCHEMBL7795443 0.86 CXCR2 (0.41) LMNAMEN1MAPTKMT2ACCR6
SCHEMBL7780580 0.85 RCE1 (0.40) LMNAMEN1MAPTHTTKMT2A
Hydrochloric Acid SCHEMBL7785319 0.85 RCE1 (0.41) LMNAMEN1MAPTHTTKMT2A
Hydrochloric Acid SCHEMBL7804207 0.82 CCR6 (0.36) MEN1KMT2ACCR6CXCL8CXCR2
SCHEMBL7789338 0.78 RCE1 (0.45) LMNAGRIN2DGRIN3BGRIN1GRIN2A
Hydrochloric Acid SCHEMBL7780764 0.77 RCE1 (0.47) MEN1KMT2AGRIN2DGRIN3BGRIN1

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
EP-1070703-A1 Cyclobutene derivatives Sankyo Company Limited (JP) 2001-01-24 EP claimed
EP-1070703-A1 Cyclobutene derivatives Sankyo Company Limited (JP) 2001-01-24 EP disclosed