SCHEMBL8577973

SCHEMBL8577973

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

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.49
HPN P05981 1/20 0.49
MAPT P10636 1/20 0.49
SIRT5 Q9NXA8 1/20 0.49
PTGS1 P23219 5/20 0.43
PTGS2 P35354 4/20 0.43
CA2 P00918 3/20 0.41
CA1 P00915 2/20 0.41
ALDH1A1 P00352 3/20 0.40
POLB P06746 1/20 0.40
TYR P14679 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
GAA P10253 2/20 0.38
KMT2A Q03164 2/20 0.38
LMNA P02545 3/20 0.38
TSHR P16473 2/20 0.38
VCAM1 P19320 2/20 0.38
RECQL P46063 1/20 0.37
MEN1 O00255 1/20 0.37
GMNN O75496 1/20 0.37

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
SCHEMBL8577784 0.91 HPN (0.46) ALOX15HPNMAPTSIRT5PTGS1
SCHEMBL9190675 0.88 HPN (0.46) ALOX15HPNMAPTSIRT5PTGS1
SCHEMBL9190670 0.87 ALOX15 (0.52) ALOX15HPNMAPTSIRT5PTGS1
SCHEMBL8578891 0.87 ALOX15 (0.52) ALOX15HPNMAPTSIRT5PTGS1
SCHEMBL7516430 0.83 ALDH1A1 (0.42) ALOX15HPNMAPTSIRT5PTGS1
SCHEMBL9190111 0.83 ALOX15 (0.55) ALOX15HPNMAPTSIRT5PTGS1
SCHEMBL5692047 0.80 ALOX15 (0.55) ALOX15HPNMAPTSIRT5PTGS1
SCHEMBL8576913 0.79 ALOX15 (0.47) ALOX15HPNMAPTSIRT5PTGS1
SCHEMBL8944903 0.79 HPN (0.44) ALOX15HPNMAPTSIRT5PTGS1
SCHEMBL8578022 0.79 HPN (0.41) ALOX15HPNMAPTSIRT5PTGS1

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