SCHEMBL1108389

SCHEMBL1108389

CC(CN(CC(O)c1ccccc1)c1cccc(S(=O)(=O)O)c1)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 3/20 0.40
NR1H2 P55055 1/20 0.39
NR1H3 Q13133 1/20 0.39
CETP P11597 1/20 0.38
TP53 P04637 4/20 0.37
MAPT P10636 4/20 0.37
GLA P06280 1/20 0.37
NR1I2 O75469 1/20 0.36
PER2 O15055 1/20 0.36
CRY1 Q16526 1/20 0.36
CRY2 Q49AN0 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
TSHR P16473 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
KDM4E B2RXH2 2/20 0.35
TAAR1 Q96RJ0 1/20 0.35
HPGD P15428 1/20 0.35
HSD11B1 P28845 1/20 0.34

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
SCHEMBL1108385 0.92 CETP (0.42) AOC3NR1H2NR1H3CETPTP53
SCHEMBL1108384 0.76 ALDH1A1 (0.41) GLAPER2CRY1CRY2SMN1; SMN2
SCHEMBL1108386 0.72 HIF1A (0.44) CETPTSHRL3MBTL1KMT2AKDM4E
SCHEMBL30302484 0.71 ALDH1A1 (0.55) SMN1; SMN2TSHRL3MBTL1MEN1KMT2A
SCHEMBL6854169 0.71 ALDH1A1 (0.55) SMN1; SMN2TSHRL3MBTL1MEN1KMT2A
SCHEMBL1108418 0.71 POLB (0.44) CETPL3MBTL1KMT2A
SCHEMBL8773481 0.70 ALDH1A1 (0.53) SMN1; SMN2TSHRL3MBTL1MEN1KMT2A
SCHEMBL12129444 0.69 TSHR (0.42) TP53MAPTSMN1; SMN2TSHRHSD11B1
SCHEMBL7888440 0.69 TSHR (0.58) NR1H2NR1H3MAPTTSHRL3MBTL1
SCHEMBL3841770 0.68 ALDH1A1 (0.44) SMN1; SMN2TSHRL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8153283-B2 Magnetic recording medium, method of modifying surface of magnetic powder and magnetic coating material FUJIFILM CORPORATION (JP) 2012-04-10 US disclosed
US-8153283-B2 Magnetic recording medium, method of modifying surface of magnetic powder and magnetic coating material FUJIFILM CORPORATION (JP) 2012-04-10 US disclosed