SCHEMBL5563669

SCHEMBL5563669

O=C(O)C12CC3CC(C1)CC(C(=O)N1CCCC1)(C3)C2

nearest known ligand 0.86

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.86
LMNA P02545 1/20 0.86
MEN1 O00255 2/20 0.83
KMT2A Q03164 2/20 0.83
HSD11B1 P28845 8/20 0.69
L3MBTL1 Q9Y468 1/20 0.68
MAPK1 P28482 1/20 0.63
RBP4 P02753 1/20 0.53
ALDH1A1 P00352 2/20 0.46
KDM4E B2RXH2 1/20 0.44
TSHR P16473 1/20 0.44
HTT P42858 1/20 0.44

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
SCHEMBL5568823 0.93 SMN1; SMN2 (1.00) SMN1; SMN2LMNAMEN1KMT2AHSD11B1
SCHEMBL12104329 0.92 SMN1; SMN2 (0.73) SMN1; SMN2LMNAMEN1KMT2AHSD11B1
SCHEMBL12104347 0.89 SMN1; SMN2 (0.68) SMN1; SMN2LMNAMEN1KMT2AHSD11B1
SCHEMBL5078675 0.86 SMN1; SMN2 (0.68) SMN1; SMN2LMNAMEN1KMT2AHSD11B1
SCHEMBL5081813 0.86 SMN1; SMN2 (0.68) SMN1; SMN2LMNAMEN1KMT2AHSD11B1
SCHEMBL3455143 0.81 SMN1; SMN2 (0.77) SMN1; SMN2LMNAMEN1KMT2AHSD11B1
SCHEMBL3456185 0.81 HSD11B1 (1.00) SMN1; SMN2LMNAMEN1KMT2AHSD11B1
SCHEMBL5085229 0.81 SMN1; SMN2 (0.78) SMN1; SMN2LMNAMEN1KMT2AHSD11B1
SCHEMBL164232 0.81 L3MBTL1 (0.58) SMN1; SMN2LMNAMEN1KMT2AHSD11B1
SCHEMBL13589980 0.81 L3MBTL1 (0.58) SMN1; SMN2LMNAMEN1KMT2AHSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070078256-A1 Prepolymers, prepolymer compositions, high-molecular-weight polymers with pore structure, and dielectric films DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2007-04-05 US disclosed
EP-1683822-A1 PREPOLYMER, PREPOLYMER COMPOSITION, HIGH MOLECULAR WEIGHT POLYMER HAVING STRUCTURE CONTAINING HOLE AND ELECTRICALLY INSULATING FILM Daicel Chemical Industries, Ltd. (JP) 2006-07-26 EP disclosed
EP-1505053-A1 Adamantanetricarboxylic acid derivatives Daicel Chemical Industries, Ltd. (JP) 2005-02-09 EP disclosed