SCHEMBL28694201

SCHEMBL28694201

Oc1c(Br)ccc(Oc2ccc(Br)c(O)c2F)c1F

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.42
MAPT P10636 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
MEN1 O00255 1/20 0.42
HPGD P15428 1/20 0.42
HTT P42858 1/20 0.42
KMT2A Q03164 1/20 0.42
ATM Q13315 1/20 0.42
AKR1B1 P15121 4/20 0.41
ALOX15 P16050 6/20 0.40
MAPK1 P28482 2/20 0.38
ALDH1A1 P00352 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
ERN1 O75460 1/20 0.36
ALOX12 P18054 3/20 0.35
TSHR P16473 1/20 0.33
GAA P10253 1/20 0.31
PKM P14618 1/20 0.31

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
SCHEMBL31644868 0.83 ERN1 (0.50) LMNAMAPTMEN1HPGDKMT2A
SCHEMBL18130015 0.79 EPHX2 (0.37) LMNAMAPTSMN1; SMN2MEN1HPGD
SCHEMBL28558265 0.78 MAPK1 (0.42) LMNAMAPTSMN1; SMN2MEN1HPGD
SCHEMBL17997262 0.78 TSHR (0.39) LMNAMAPTSMN1; SMN2MEN1HPGD
SCHEMBL17997273 0.75 HPGD (0.42) LMNAMAPTSMN1; SMN2MEN1HPGD
SCHEMBL14282688 0.74 PKM (0.59) SMN1; SMN2TDP1L3MBTL1TSHRPKM
SCHEMBL20090376 0.74 FURIN (0.35) KMT2AERN1
SCHEMBL5093457 0.74 ESR1 (0.40) LMNASMN1; SMN2MEN1HTTKMT2A
SCHEMBL28694200 0.73 ALOX15 (0.39) LMNAMAPTSMN1; SMN2MEN1HPGD
SCHEMBL1864874 0.73 CES2 (0.36) LMNAMAPTSMN1; SMN2MEN1HPGD

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-114105919-A Liquid crystal compound and preparation method and application thereof 北京八亿时空液晶科技股份有限公司 2022-03-01 CN disclosed