SCHEMBL13142202

SCHEMBL13142202

CCC(C)(CC)Oc1ccc(Oc2ccc(C(=O)c3ccc(C)c(S(=O)(=O)O)c3)cc2S(=O)(=O)O)c2ccccc12

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ MAPT P10636 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ FABP4 P15090 1/20 0.35
▸ POLB P06746 4/20 0.35
▸ L3MBTL1 Q9Y468 3/20 0.35
▸ APEX1 P27695 2/20 0.35
▸ NSD2 O96028 1/20 0.35
▸ ESR1 P03372 1/20 0.35
▸ RECQL P46063 1/20 0.35
▸ ESR2 Q92731 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ HSD17B10 Q99714 2/20 0.33
▸ ALOX15 P16050 2/20 0.33
▸ RAD52 P43351 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ DUSP3 P51452 1/20 0.33
▸ PTPN5 P54829 1/20 0.33
▸ PTPN11 Q06124 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
SCHEMBL10034448 0.85 FABP4 (0.48) LMNAALDH1A1MAPTKMT2AFABP4
SCHEMBL14364640 0.84 ALDH1A1 (0.32) LMNAALDH1A1MAPTKMT2AELANE
SCHEMBL14364633 0.80 CNR2 (0.32) LMNAALDH1A1MAPTKMT2ACNR2
SCHEMBL10034454 0.76 CDC25B (0.40) LMNAALDH1A1MAPTKMT2AFABP4
SCHEMBL10066812 0.74 ALDH1A1 (0.35) LMNAALDH1A1MAPTKMT2APOLB
SCHEMBL10066819 0.74 ALDH1A1 (0.31) LMNAALDH1A1MAPTKMT2AHSD17B10
SCHEMBL14364635 0.74 ALDH1A1 (0.31) LMNAALDH1A1MAPTKMT2AHSD17B10
SCHEMBL12834717 0.74 ESRRA (0.36) LMNAALDH1A1MAPTKMT2APOLB
SCHEMBL12807619 0.73 CASP1 (0.33) LMNAALDH1A1MAPTKMT2AHSD17B10
SCHEMBL10067128 0.73 ELANE (0.33) LMNAALDH1A1MAPTKMT2APOLB

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
EP-1862489-B1 Block Copolymer and Use Thereof SUMITOMO CHEMICAL CO (JP) 2010-10-06 — — EP disclosed
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