SCHEMBL28037271

SCHEMBL28037271

BrC(CC1CCCCO1)OC(Br)CC1CCCCO1

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.33
USP2 O75604 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HPGD P15428 3/20 0.32
TP53 P04637 1/20 0.32
ALOX12 P18054 1/20 0.32
KMT2A Q03164 2/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HTT P42858 1/20 0.30

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
SCHEMBL8917680 0.82 KMT2A (0.31) SMN1; SMN2HPGDKMT2AMEN1ALDH1A1
SCHEMBL7639692 0.78 USP2 (0.37) LMNAPOLBUSP2SMN1; SMN2HPGD
SCHEMBL12089502 0.72 PDE8B (0.36) USP2SMN1; SMN2HPGDTP53ALOX12
SCHEMBL8860611 0.72 PDE8B (0.36) USP2SMN1; SMN2HPGDTP53ALOX12
SCHEMBL19193766 0.72 USP2 (0.35) LMNAPOLBUSP2SMN1; SMN2HPGD
SCHEMBL12090067 0.72 PDE8B (0.36) USP2SMN1; SMN2HPGDTP53ALOX12
SCHEMBL22145206 0.72 USP2 (0.40) LMNAPOLBUSP2SMN1; SMN2HPGD
SCHEMBL29018459 0.72 USP2 (0.40) LMNAPOLBUSP2SMN1; SMN2HPGD
SCHEMBL797696 0.71 PDE8B (0.35) USP2SMN1; SMN2HPGDTP53ALOX12
SCHEMBL6137050 0.71 USP2 (0.35) LMNAPOLBUSP2SMN1; SMN2HPGD

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
CN-105037335-A Preparation method for 2,7'-di(4-pyridyl)-9-(15-crown-4)fluorene ligand XIONG LILI 2015-11-11 CN disclosed