SCHEMBL9737712

SCHEMBL9737712

[Li]c1[nH]c2ccc(OC)cc2c1S(=O)(=O)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.49
MAPT P10636 5/20 0.49
MEN1 O00255 4/20 0.49
KMT2A Q03164 4/20 0.49
KDM4E B2RXH2 3/20 0.49
HPGD P15428 3/20 0.49
HSD17B10 Q99714 2/20 0.49
ABCG2 Q9UNQ0 1/20 0.48
GFER P55789 2/20 0.47
TSHR P16473 1/20 0.47
TUBB4A P04350 2/20 0.47
TUBB P07437 2/20 0.47
TUBA3C P0DPH7 2/20 0.47
TUBA1B P68363 2/20 0.47
TUBA4A P68366 2/20 0.47
TUBB4B P68371 2/20 0.47
TUBB3 Q13509 2/20 0.47
TUBB2A Q13885 2/20 0.47
TUBB8 Q3ZCM7 2/20 0.47
TUBA3E Q6PEY2 2/20 0.47

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
SCHEMBL11015974 0.82 CA2 (0.47) ALDH1A1MAPTMEN1KMT2AKDM4E
Lithium Ion SCHEMBL11017535 0.79 ABCG2 (0.46) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL9955331 0.78 TUBB4A (0.51) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL5261284 0.76 ALDH1A1 (0.49) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL19717983 0.75 ALDH1A1 (0.52) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL5784803 0.73 MAPT (0.78) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL9737118 0.72 MAPT (0.45) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL7245923 0.71 CA2 (0.65) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL9737778 0.71 MAPT (0.60) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL19718029 0.69 ALDH1A1 (0.43) ALDH1A1MAPTMEN1KMT2AKDM4E

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
US-5079363-A From an alkoxypyridine and an indole derivative, antitumor and antileukemia agents SANOFI (FR) 1992-01-07 US disclosed