SCHEMBL21699313

SCHEMBL21699313

O=S(=O)(c1ccccc1)c1nc2c3nc(S(=O)(=O)c4ccccc4)c(S(=O)(=O)c4ccccc4)nc3c3nc(S(=O)(=O)C4C=CC=CC4)c(S(=O)(=O)c4ccccc4)nc3c2nc1S(=O)(=O)c1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 4/20 0.35
LMNA P02545 1/20 0.34
RECQL P46063 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
HTR6 P50406 1/20 0.34
ALDH1A1 P00352 7/20 0.33
KMT2A Q03164 4/20 0.33
MAPT P10636 4/20 0.33
MEN1 O00255 3/20 0.33
KDM4E B2RXH2 2/20 0.33
MAPK1 P28482 2/20 0.33
NPSR1 Q6W5P4 2/20 0.32
HPGD P15428 1/20 0.32
ABCB1 P08183 2/20 0.31
ABCC1 P33527 2/20 0.31
NLRP3 Q96P20 1/20 0.31
RAB9A P51151 2/20 0.31
TP53 P04637 1/20 0.31
AKR1B1 P15121 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
SCHEMBL5075753 0.79 MAPT (0.38) SMN1; SMN2L3MBTL1HTR6ALDH1A1KMT2A
SCHEMBL45909 0.75 HTR6 (0.59) PIK3CASMN1; SMN2HTR6ALDH1A1KMT2A
SCHEMBL7880039 0.70 CYP2A6 (0.38) LMNASMN1; SMN2HTR6ALDH1A1MAPT
SCHEMBL20928860 0.70 L3MBTL1 (0.35) SMN1; SMN2L3MBTL1HTR6ALDH1A1KMT2A
SCHEMBL19648502 0.66 L3MBTL1 (0.33) L3MBTL1
SCHEMBL14654613 0.66 CYP3A4 (0.32) L3MBTL1
SCHEMBL22269145 0.66 CA12 (0.34) L3MBTL1
SCHEMBL19904859 0.66 L3MBTL1 (0.33) L3MBTL1
SCHEMBL15866601 0.66 HTR6 (0.38) PIK3CALMNARECQLSMN1; SMN2L3MBTL1
SCHEMBL24381717 0.65 TSHR (0.35) LMNASMN1; SMN2L3MBTL1ALDH1A1KMT2A

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-2996169-B1 ORGANIC LIGHT EMITTING DIODE LG DISPLAY CO LTD (KR) 2020-02-12 EP disclosed