SCHEMBL6568130

SCHEMBL6568130

C=C(C)C(=O)Sc1ccc(C)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.44
HPGD P15428 4/20 0.44
ALDH1A1 P00352 5/20 0.41
LMNA P02545 3/20 0.41
HTT P42858 1/20 0.41
KMT2A Q03164 1/20 0.41
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
HSD17B10 Q99714 1/20 0.38
CES2 O00748 1/20 0.38
CES1 P23141 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
NR1I2 O75469 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
TP53 P04637 1/20 0.36
MAPK1 P28482 1/20 0.36
RAB9A P51151 1/20 0.36
FKBP1A P62942 1/20 0.36
DNMT1 P26358 1/20 0.35

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
SCHEMBL1803064 0.91 HPGD (0.39) MAPTHPGDALDH1A1LMNAHTT
SCHEMBL158581 0.85 HPGD (0.50) MAPTHPGDALDH1A1LMNAHTT
SCHEMBL16170747 0.85 L3MBTL1 (0.35) MAPTHPGDALDH1A1LMNAHTT
SCHEMBL7575059 0.85 L3MBTL1 (0.35) MAPTHPGDALDH1A1LMNAHTT
SCHEMBL16170509 0.85 L3MBTL1 (0.35) MAPTHPGDALDH1A1LMNAHTT
SCHEMBL4828988 0.82 MAPT (0.49) MAPTHPGDALDH1A1LMNAHTT
SCHEMBL16170453 0.82 ELANE (0.42) MAPTHPGDALDH1A1LMNAHTT
SCHEMBL26192623 0.82 L3MBTL1 (0.33) MAPTHPGDLMNA
SCHEMBL26192574 0.82 L3MBTL1 (0.33) MAPTHPGDLMNA
SCHEMBL16170572 0.82 LMNA (0.42) MAPTHPGDALDH1A1LMNAHTT

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-1478403-A1 RESPONSIVE MICROGEL AND METHODS RELATED THERETO SUPRATEK PHARMA, INC. (CA) 2004-11-24 EP disclosed
WO-2003063909-A1 RESPONSIVE MICROGEL AND METHODS RELATED THERETO SUPRATEK PHARMA INC. (US) 2003-08-07 WO disclosed