SCHEMBL5566593

SCHEMBL5566593

Cc1cc(C)c(C(=O)P(CC(C)C)C(=O)c2c(C)cc(C)cc2C)c(C)c1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.39
NPSR1 Q6W5P4 1/20 0.39
MCOLN3 Q8TDD5 1/20 0.39
MEN1 O00255 4/20 0.36
KMT2A Q03164 4/20 0.36
LMNA P02545 3/20 0.36
KDM4E B2RXH2 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ALDH1A1 P00352 4/20 0.34
MAPT P10636 2/20 0.34
MAPK1 P28482 1/20 0.34
TAS1R3 Q7RTX0 2/20 0.33
TAS1R1 Q7RTX1 2/20 0.33
TAS1R2 Q8TE23 2/20 0.33
GAA P10253 1/20 0.33
CRHR1 P34998 1/20 0.32

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
SCHEMBL27885467 0.84 HPGD (0.38) HPGDNPSR1MCOLN3MEN1KMT2A
SCHEMBL7073228 0.80 L3MBTL1 (0.37) HPGDNPSR1MCOLN3MEN1KMT2A
SCHEMBL1038660 0.79 HPGD (0.33) HPGDNPSR1MCOLN3MEN1KMT2A
SCHEMBL28667031 0.77 CPA1 (0.36) HPGDNPSR1MCOLN3MEN1KMT2A
SCHEMBL1037184 0.77 LMNA (0.38) HPGDNPSR1MCOLN3MEN1KMT2A
SCHEMBL1034997 0.76 KDM4E (0.40) HPGDNPSR1MCOLN3MEN1KMT2A
SCHEMBL12956434 0.74 LMNA (0.40) HPGDNPSR1MCOLN3MEN1KMT2A
SCHEMBL21111136 0.74 KMT2A (0.39) HPGDNPSR1MCOLN3MEN1KMT2A
SCHEMBL15637944 0.74 SMN1; SMN2 (0.39) HPGDNPSR1MCOLN3MEN1KMT2A
SCHEMBL27505496 0.74 HPGD (0.36) HPGDNPSR1MCOLN3MEN1KMT2A

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-0909288-B1 PROCESS FOR CURING A POLYMERIZABLE COMPOSITION CIBA SC HOLDING AG (CH) 2007-06-27 EP claimed
US-5534559-A UNSATURATED POLYESTERS CIBA-GEIGY CORPORATION (US) 1996-07-09 US disclosed