SCHEMBL6155416

SCHEMBL6155416

CCN(C(=O)CCC(C)(C)O)c1cccc(O[Si](C)(C)C(C)(C)C)c1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.38
HSP90AB1 P08238 1/20 0.38
MTNR1A P48039 1/20 0.38
MTNR1B P49286 1/20 0.38
POLQ O75417 4/20 0.37
MAPT P10636 3/20 0.37
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA9 Q16790 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
MLYCD O95822 1/20 0.34
TP53 P04637 2/20 0.34
RXFP1 Q9HBX9 1/20 0.34
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C19 P33261 1/20 0.33
POLB P06746 1/20 0.33

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
SCHEMBL6155455 0.87 MTNR1A (0.41) HSP90AA1HSP90AB1MTNR1AMTNR1BPOLQ
SCHEMBL30206480 0.76 RAB9A (0.47) HSP90AA1HSP90AB1MAPTMEN1KMT2A
SCHEMBL6156114 0.74 LTB4R (0.36) MTNR1AMTNR1BPOLQMAPTMEN1
SCHEMBL6156119 0.74 NR4A1 (0.40) KMT2A
SCHEMBL6156109 0.73 CFD (0.39)
SCHEMBL31738064 0.73 F2 (0.39) HSP90AA1HSP90AB1MTNR1AMTNR1BCA12
SCHEMBL6881287 0.70 MEN1 (0.46) MAPTMEN1KMT2ACYP3A4POLB
SCHEMBL6881282 0.70 POLB (0.43) MTNR1AMTNR1BCA1POLB
SCHEMBL7706827 0.68 CA1 (0.50) HSP90AA1HSP90AB1MAPTMEN1KMT2A
SCHEMBL2676116 0.68 HSP90AA1 (0.41) HSP90AA1HSP90AB1KMT2ACA12CA1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1124779-B1 VITAMIN D ANALOGUES GALDERMA RES & DEV (FR) 2005-02-02 EP disclosed
US-6689922-B1 BIAROMATIC COMPOUNDS WHICH ARE ANALOGUES OF VITAMIN D HAVE A MARKED ACTIVITY IN THE FIELDS OF CELL DIFFERENTIATION AND PROLIFERATION GALDERMA RESEARCH & DEVELOPMENT S.N.C. (FR) 2004-02-10 US disclosed
EP-1124779-A1 VITAMIN D ANALOGUES Galderma Research & Development, S.N.C. (FR) 2001-08-22 EP disclosed
WO-2000026167-A1 VITAMIN D ANALOGUES GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2000-05-11 WO disclosed