SCHEMBL11227892

SCHEMBL11227892

COC(=O)c1c(C(=O)OC)c(C(=O)OC)c(-c2ccccc2)c(-c2ccccc2)c1C(=O)OC

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.64
ALDH1A1 P00352 3/20 0.57
SMN1; SMN2 Q16637 3/20 0.57
RAB9A P51151 1/20 0.57
TP53 P04637 2/20 0.54
AR P10275 1/20 0.54
TSHR P16473 1/20 0.54
HTT P42858 1/20 0.53
CA12 O43570 1/20 0.52
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
CA7 P43166 1/20 0.52
CA9 Q16790 1/20 0.52
CA14 Q9ULX7 1/20 0.52
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
HPGD P15428 1/20 0.51
PRKCZ Q05513 1/20 0.51
PTGS1 P23219 1/20 0.51
GABRA1 P14867 1/20 0.50

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
SCHEMBL13228941 0.86 SMN1; SMN2 (0.56) LMNAALDH1A1SMN1; SMN2RAB9ATP53
SCHEMBL19397824 0.84 FGFR1 (0.56) LMNAALDH1A1SMN1; SMN2RAB9ATP53
SCHEMBL4446092 0.84 LMNA (0.60) LMNAALDH1A1SMN1; SMN2RAB9ATP53
SCHEMBL28391493 0.82 SMN1; SMN2 (0.60) LMNAALDH1A1SMN1; SMN2RAB9ATP53
SCHEMBL505248 0.81 LMNA (0.57) LMNAALDH1A1SMN1; SMN2RAB9ATP53
SCHEMBL27516914 0.81 ALDH1A1 (0.58) LMNAALDH1A1SMN1; SMN2RAB9ATP53
SCHEMBL5166558 0.80 SMN1; SMN2 (0.75) LMNAALDH1A1SMN1; SMN2RAB9ATP53
SCHEMBL13228930 0.79 HTT (0.62) LMNAALDH1A1SMN1; SMN2RAB9ATSHR
SCHEMBL8471993 0.78 LMNA (0.58) LMNAALDH1A1SMN1; SMN2RAB9ATP53
SCHEMBL29106646 0.78 LMNA (0.58) LMNAALDH1A1SMN1; SMN2RAB9ATP53

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-4339595-A Hexa(meta-,para-carboxyphenyl)benzene compounds STANDARD OIL COMPANY (INDIANA) (US) 1982-07-13 US disclosed