SCHEMBL9819191

SCHEMBL9819191

C=CC(=O)OOCCOc1ccc(CC(C)(O)C=O)cc1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
THRB P10828 4/20 0.41
ALDH1A1 P00352 5/20 0.37
KDM4E B2RXH2 4/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
LMNA P02545 3/20 0.36
GAA P10253 2/20 0.36
THRA P10827 1/20 0.36
ACACB O00763 2/20 0.36
EBP Q15125 1/20 0.35
SIGMAR1 Q99720 1/20 0.35
KMT2A Q03164 1/20 0.34
PPARA Q07869 3/20 0.33
PPARG P37231 2/20 0.33
PPARD Q03181 1/20 0.33
MITF O75030 1/20 0.33
HPGD P15428 1/20 0.33
HTT P42858 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
SCHEMBL9174795 0.88 THRB (0.56) THRBALDH1A1KDM4ESMN1; SMN2LMNA
SCHEMBL8772904 0.86 THRB (0.42) THRBALDH1A1KDM4ESMN1; SMN2LMNA
SCHEMBL9819123 0.82 THRB (0.56) THRBALDH1A1LMNATHRAKMT2A
SCHEMBL9575718 0.79 ALDH1A1 (0.39) ALDH1A1KDM4ESMN1; SMN2LMNAGAA
SCHEMBL6346562 0.79 THRB (0.43) THRBALDH1A1GAAPPARAHTT
SCHEMBL19644362 0.77 SMN1; SMN2 (0.50) ALDH1A1KDM4ESMN1; SMN2LMNAGAA
SCHEMBL788296 0.77 SMN1; SMN2 (0.50) ALDH1A1KDM4ESMN1; SMN2LMNAGAA
SCHEMBL10455828 0.77 LMNA (0.39) ALDH1A1KDM4ESMN1; SMN2LMNAACACB
SCHEMBL9819180 0.77 POLB (0.48) THRBALDH1A1KDM4ESMN1; SMN2LMNA
SCHEMBL9614864 0.76 SMN1; SMN2 (0.48) ALDH1A1SMN1; SMN2LMNAACACBEBP

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-0217205-B1 COPOLYMERISABLE PHOTOINITIATORS CIBA-GEIGY AG (CH) 1991-12-11 EP disclosed