SCHEMBL8850418

SCHEMBL8850418

O=C(OCc1ccccc1)c1ccc(C(O)c2occc(=O)c2OCc2ccccc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.49
GAA P10253 2/20 0.49
KMT2A Q03164 4/20 0.48
TDP1 Q9NUW8 3/20 0.48
SLC6A2 P23975 1/20 0.48
SLC6A3 Q01959 1/20 0.48
MAPT P10636 5/20 0.44
ALDH1A1 P00352 2/20 0.44
RAB9A P51151 2/20 0.44
NPC1 O15118 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HPGD P15428 2/20 0.43
ADRB2 P07550 1/20 0.40
ADRB1 P08588 1/20 0.40
ADRB3 P13945 1/20 0.40
MEN1 O00255 1/20 0.39
MAOB P27338 2/20 0.39
PRKDC P78527 2/20 0.38
MAOA P21397 1/20 0.38
L3MBTL1 Q9Y468 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
SCHEMBL6197659 0.87 LMNA (0.59) LMNAGAAKMT2AALDH1A1NPC1
SCHEMBL6195867 0.84 LMNA (0.53) LMNAGAAKMT2AMAPTALDH1A1
SCHEMBL6196494 0.84 LMNA (0.60) LMNAGAAKMT2AMAPTALDH1A1
SCHEMBL6197598 0.84 LMNA (0.53) LMNAGAAKMT2AALDH1A1SMN1; SMN2
SCHEMBL6196338 0.84 LMNA (0.53) LMNAGAAKMT2AALDH1A1SMN1; SMN2
SCHEMBL6198576 0.81 LMNA (0.53) LMNAGAAKMT2AMAPTALDH1A1
SCHEMBL6198044 0.81 LMNA (0.50) LMNAGAAMAPTHPGDMAOB
SCHEMBL6195803 0.80 LMNA (0.49) LMNAGAAKMT2AMAPTRAB9A
SCHEMBL6195402 0.80 LMNA (0.51) LMNAGAAKMT2ANPC1SMN1; SMN2
SCHEMBL6200128 0.76 LMNA (0.50) LMNAGAAKMT2ATDP1RAB9A

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-5688815-A COMPOUNDS FOR REMOVAL OF EXCESS IRON IN MAMMALS CIBA GEIGY CORPORATION (US) 1997-11-18 US disclosed