SCHEMBL6155455

SCHEMBL6155455

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

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 1/20 0.41
MTNR1B P49286 1/20 0.41
HSP90AA1 P07900 1/20 0.39
HSP90AB1 P08238 1/20 0.39
POLQ O75417 4/20 0.38
MAPT P10636 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.35
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
CA12 O43570 2/20 0.34
CA1 P00915 2/20 0.34
CA9 Q16790 2/20 0.34
HDAC8 Q9BY41 1/20 0.34
TP53 P04637 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34

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
SCHEMBL6155416 0.87 HSP90AA1 (0.38) MTNR1AMTNR1BHSP90AA1HSP90AB1POLQ
SCHEMBL30206480 0.77 RAB9A (0.47) HSP90AA1HSP90AB1MAPTSMN1; SMN2MEN1
SCHEMBL31738064 0.74 F2 (0.39) MTNR1AMTNR1BHSP90AA1HSP90AB1CA12
SCHEMBL6879525 0.70 MEN1 (0.47) MAPTMEN1KMT2A
SCHEMBL6879522 0.70 ALDH1A1 (0.45) MTNR1AMTNR1BKMT2A
SCHEMBL341880 0.69 KMT2A (0.53) HSP90AA1HSP90AB1SMN1; SMN2MEN1KMT2A
SCHEMBL7706827 0.69 CA1 (0.50) HSP90AA1HSP90AB1MAPTSMN1; SMN2MEN1
SCHEMBL2676116 0.69 HSP90AA1 (0.41) HSP90AA1HSP90AB1KMT2ACA12CA1
SCHEMBL15266769 0.68 ALDH1A1 (0.48) MTNR1AMTNR1BPOLQMAPTSMN1; SMN2
SCHEMBL1077335 0.68 CNR2 (0.42) HSP90AA1HSP90AB1MEN1KMT2ACA12

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