SCHEMBL8716077

SCHEMBL8716077

O=C(Cc1ccccc1)c1ccc2c(c1)CC(N1C(=O)c3ccccc3C1=O)C2

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
S1PR5 Q9H228 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
KDM4E B2RXH2 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
L3MBTL1 Q9Y468 3/20 0.40
MAPT P10636 3/20 0.40
PLAU P00749 1/20 0.40
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
SRD5A2 P31213 2/20 0.40
ALOX15 P16050 1/20 0.38
HPGD P15428 1/20 0.38
GAA P10253 1/20 0.37
ALDH1A1 P00352 1/20 0.37
GRM1 Q13255 1/20 0.37

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
SCHEMBL8718162 0.82 L3MBTL1 (0.38) SMN1; SMN2KDM4ENPC1RAB9AL3MBTL1
SCHEMBL8718165 0.78 LMNA (0.40) SMN1; SMN2KDM4ENPC1L3MBTL1KMT2A
SCHEMBL8719002 0.77 L3MBTL1 (0.37) SMN1; SMN2L3MBTL1KMT2AMEN1SRD5A2
SCHEMBL3977324 0.74 CRBN (0.42) SMN1; SMN2KDM4ERAB9AL3MBTL1MAPT
SCHEMBL4070816 0.74 SRD5A2 (0.58) S1PR5SMN1; SMN2KDM4ENPC1RAB9A
SCHEMBL1099201 0.73 HTR2C (0.46) L3MBTL1KMT2AALDH1A1
SCHEMBL11366826 0.72 ALDH1A1 (0.45) S1PR5SMN1; SMN2KDM4ENPC1RAB9A
SCHEMBL8715545 0.72 PDE4A (0.39) SMN1; SMN2L3MBTL1MAPTKMT2AMEN1
SCHEMBL6588410 0.72 CYP2D6 (0.46) SMN1; SMN2KDM4ENPC1RAB9AL3MBTL1
SCHEMBL22815698 0.70 ADRA1D (0.40) L3MBTL1KMT2AMEN1ALDH1A1

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-5739132-A ENDOTHOXIN SHOCK; NEPHRITIS TANABE SEIYAKU CO., LTD. (JP) 1998-04-14 US disclosed
EP-0579059-A1 Pyridazinone derivatives and processes for preparing the same TANABE SEIYAKU CO., LTD. (JP) 1994-01-19 EP disclosed