SCHEMBL9856537

SCHEMBL9856537

CCCCCCOC(=O)c1ccc(C(=O)Oc2ccccc2)cc1.[NaH]

nearest known ligand 0.67

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.67
ALDH1A1 P00352 4/20 0.67
MEN1 O00255 2/20 0.67
HPGD P15428 2/20 0.67
KMT2A Q03164 2/20 0.67
NPC1 O15118 2/20 0.62
RAB9A P51151 1/20 0.62
TSHR P16473 2/20 0.59
LMNA P02545 2/20 0.59
TDP1 Q9NUW8 1/20 0.58
STS P08842 5/20 0.58
THRB P10828 1/20 0.56
TP53 P04637 1/20 0.56
CYP3A4 P08684 1/20 0.56
MAPK1 P28482 1/20 0.56
NFKB1 P19838 1/20 0.56
NFKB2 Q00653 1/20 0.56
RELA Q04206 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56

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
SCHEMBL9856943 0.96 MAPT (0.73) MAPTALDH1A1MEN1HPGDKMT2A
SCHEMBL9856535 0.94 MAPT (0.63) MAPTALDH1A1MEN1HPGDKMT2A
SCHEMBL11856660 0.93 MAPT (0.64) MAPTALDH1A1MEN1HPGDKMT2A
SCHEMBL19373811 0.91 MAPT (0.74) MAPTALDH1A1MEN1HPGDKMT2A
SCHEMBL10344104 0.91 MAPT (0.74) MAPTALDH1A1MEN1HPGDKMT2A
SCHEMBL19373809 0.91 MAPT (0.74) MAPTALDH1A1MEN1HPGDKMT2A
SCHEMBL19373815 0.91 MAPT (0.74) MAPTALDH1A1MEN1HPGDKMT2A
SCHEMBL19373805 0.91 MAPT (0.74) MAPTALDH1A1MEN1HPGDKMT2A
SCHEMBL19373812 0.91 MAPT (0.74) MAPTALDH1A1MEN1HPGDKMT2A
SCHEMBL19373817 0.91 MAPT (0.74) MAPTALDH1A1MEN1HPGDKMT2A

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-0426217-A2 Bleach precursors UNILEVER N.V. (NL) 1991-05-08 EP disclosed