SCHEMBL3633653

SCHEMBL3633653

O=C(Cl)c1ccoc1C(F)(F)F

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.38
TSHR P16473 1/20 0.38
ALDH1A1 P00352 2/20 0.36
ALOX15 P16050 1/20 0.36
RXFP1 Q9HBX9 1/20 0.34
HTT P42858 3/20 0.33
LMNA P02545 1/20 0.33
HPGD P15428 1/20 0.33
SCD O00767 1/20 0.33
POLB P06746 1/20 0.33
RAB9A P51151 2/20 0.31
NPC1 O15118 1/20 0.31
GAA P10253 1/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
NPSR1 Q6W5P4 1/20 0.31
MAOB P27338 1/20 0.31
XDH P47989 1/20 0.30
SLC22A12 Q96S37 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
SCHEMBL939256 0.82 XDH (0.39) SMN1; SMN2ALDH1A1ALOX15RXFP1HPGD
SCHEMBL6971332 0.76 SCD (0.33) SMN1; SMN2TSHRRXFP1HTTLMNA
SCHEMBL6464252 0.76 CFTR (0.44) SMN1; SMN2TSHRALDH1A1RXFP1HTT
SCHEMBL19066745 0.74
SCHEMBL4441896 0.70 ALDH1A1 (0.37) TSHRALDH1A1ALOX15HTTPOLB
SCHEMBL28878067 0.68 HTR2C (0.39) SMN1; SMN2ALDH1A1ALOX15HTTLMNA
SCHEMBL29967942 0.68 HTR2C (0.39) SMN1; SMN2ALDH1A1ALOX15HTTLMNA
SCHEMBL3057644 0.68
SCHEMBL15264610 0.68
SCHEMBL1164338 0.68

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103108868-B Furyl compounds and uses thereof NOVOMEDIX, LLC (US) 2015-11-25 CN disclosed
CN-104860907-A Furanyl compounds and the use thereof NOVOMEDIX LLC 2015-08-26 CN disclosed
EP-2148868-A1 NOVEL AROMATIC HETEROCYCLIC CARBOXYLIC ACID AMIDE DERIVATIVES USEFUL AS POTASSIUM CHANNEL MODULATORS NeuroSearch A/S (DK) 2010-02-03 EP disclosed
WO-2008138917-A1 NOVEL AROMATIC HETEROCYCLIC CARBOXYLIC ACID AMIDE DERIVATIVES USEFUL AS POTASSIUM CHANNEL MODULATORS NEUROSEARCH A/S (DK) 2008-11-20 WO disclosed