SCHEMBL10823591

SCHEMBL10823591

O=C(Nc1ccc(S(=O)(=O)Nc2ccc3ccc(S(=O)(=O)O)cc3c2O)cc1)Nc1ccc(S(=O)(=O)Nc2ccc3ccc(S(=O)(=O)O)cc3c2O)cc1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PRMT1 Q99873 2/20 0.50
CHEK1 O14757 1/20 0.50
CDK8 P49336 1/20 0.50
NEK2 P51955 1/20 0.50
LIMK1 P53667 1/20 0.50
LMNA P02545 2/20 0.45
TIMP3 P35625 3/20 0.45
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
MAPT P10636 1/20 0.44
HTT P42858 1/20 0.44
FASN P49327 1/20 0.43
GAA P10253 1/20 0.42
SIRT1 Q96EB6 1/20 0.42

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
SCHEMBL10823703 0.91 PRMT1 (0.55) PRMT1CHEK1CDK8NEK2LIMK1
SCHEMBL10823438 0.88 MEN1 (0.49) PRMT1CHEK1CDK8NEK2LIMK1
SCHEMBL11351829 0.84 TIMP3 (0.58) PRMT1LMNATIMP3MEN1KMT2A
SCHEMBL10823694 0.82 PRMT1 (0.53) PRMT1LMNATIMP3MEN1KMT2A
SCHEMBL10823455 0.82 PRMT1 (0.53) PRMT1LMNATIMP3MEN1KMT2A
SCHEMBL10823561 0.80 PRMT1 (0.51) PRMT1CHEK1CDK8NEK2LIMK1
SCHEMBL10823632 0.80 PRMT1 (0.60) PRMT1LMNATIMP3SIRT1
SCHEMBL10823413 0.80 PRMT1 (0.53) PRMT1LMNATIMP3KMT2ASIRT1
SCHEMBL10823698 0.79 PRMT1 (0.55) PRMT1LMNAMEN1KMT2AMAPT
SCHEMBL10823431 0.78 CHEK1 (0.45) CHEK1CDK8NEK2LIMK1LMNA

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-H83-H Dental antiplaque agents and inhibitors of connective tissue destruction AMERICAN CYANAMID COMPANY (US) 1986-07-01 US disclosed