SCHEMBL8047879

SCHEMBL8047879

CC(C)=CCOC(=O)C12CC3CC(CC(C3)C1)C2

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.47
NPSR1 Q6W5P4 3/20 0.47
MAPT P10636 3/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
PRKCA P17252 1/20 0.46
CYP17A1 P05093 2/20 0.44
CYP19A1 P11511 2/20 0.44
ATM Q13315 1/20 0.43
PKM P14618 1/20 0.41
LMNA P02545 2/20 0.41
KDM4E B2RXH2 1/20 0.40
MAPK1 P28482 1/20 0.40
SCN1A P35498 1/20 0.40
SCN2A Q99250 1/20 0.40
SCN3A Q9NY46 1/20 0.40
GAA P10253 1/20 0.39
XBP1 P17861 1/20 0.39

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
SCHEMBL7797331 0.79 ALDH1A1 (0.50) ALDH1A1NPSR1MAPTMEN1KMT2A
SCHEMBL1073543 0.76 LMNA (0.59) ALDH1A1NPSR1MAPTMEN1KMT2A
SCHEMBL12132675 0.75 ALDH1A1 (0.58) ALDH1A1NPSR1MAPTMEN1KMT2A
SCHEMBL7110123 0.74 NPSR1 (0.50) ALDH1A1NPSR1MAPTMEN1KMT2A
SCHEMBL7475995 0.73 NPSR1 (0.53) ALDH1A1NPSR1MAPTMEN1KMT2A
SCHEMBL13799126 0.73 ALDH1A1 (0.51) ALDH1A1NPSR1MAPTMEN1KMT2A
SCHEMBL482690 0.72 ALDH1A1 (0.50) ALDH1A1NPSR1MAPTMEN1KMT2A
SCHEMBL10414853 0.72 PRKCA (0.57) ALDH1A1NPSR1MAPTMEN1KMT2A
SCHEMBL1439271 0.72 ALDH1A1 (0.54) ALDH1A1NPSR1MAPTMEN1KMT2A
SCHEMBL6895298 0.72 ALDH1A1 (0.54) ALDH1A1NPSR1MAPTMEN1KMT2A

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-6010826-A Resist composition NIPPON ZEON CO., LTD. (JP) 2000-01-04 US disclosed
EP-0786701-A1 RESIST COMPOSITION NIPPON ZEON CO., LTD. (JP) 1997-07-30 EP disclosed