SCHEMBL8577784

SCHEMBL8577784

CCCC[Si](CCCC)(CCCC)CSc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPN P05981 1/20 0.46
MAPT P10636 1/20 0.46
ALOX15 P16050 1/20 0.46
SIRT5 Q9NXA8 1/20 0.46
PTGS1 P23219 6/20 0.41
PTGS2 P35354 5/20 0.41
CA2 P00918 2/20 0.39
CA1 P00915 1/20 0.39
NR5A2 O00482 1/20 0.38
NR5A1 Q13285 1/20 0.38
ALDH1A1 P00352 2/20 0.38
POLB P06746 1/20 0.38
TYR P14679 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
GAA P10253 2/20 0.37
KMT2A Q03164 1/20 0.37
VCAM1 P19320 2/20 0.36
LMNA P02545 2/20 0.36
TSHR P16473 1/20 0.36
RECQL P46063 1/20 0.36

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
SCHEMBL9190675 0.97 HPN (0.46) HPNMAPTALOX15SIRT5PTGS1
SCHEMBL8577973 0.91 ALOX15 (0.49) HPNMAPTALOX15SIRT5PTGS1
SCHEMBL7521708 0.84 ALDH1A1 (0.40) HPNMAPTALOX15SIRT5PTGS1
SCHEMBL8578891 0.84 ALOX15 (0.52) HPNMAPTALOX15SIRT5PTGS1
SCHEMBL9190670 0.84 ALOX15 (0.52) HPNMAPTALOX15SIRT5PTGS1
SCHEMBL8944903 0.82 HPN (0.44) HPNMAPTALOX15SIRT5PTGS1
SCHEMBL9190111 0.80 ALOX15 (0.55) HPNMAPTALOX15SIRT5PTGS1
SCHEMBL8578913 0.80 HPN (0.39) HPNMAPTALOX15SIRT5PTGS1
SCHEMBL8699143 0.79 HPN (0.53) HPNMAPTALOX15SIRT5PTGS1
SCHEMBL9504471 0.78 ALOX15 (0.52) HPNMAPTALOX15SIRT5PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5795876-A ANTIINFLAMMATORY AGENTS HOECHST MARION ROUSSSEL, INC. (US) 1998-08-18 US disclosed