SCHEMBL8519145

SCHEMBL8519145

CNS(=O)(=O)c1cccc(NC(=N)Nc2cc(Br)ccc2Br)c1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TNNI3K Q59H18 10/20 0.47
LMNA P02545 2/20 0.43
PTBP1 P26599 1/20 0.43
EGFR P00533 2/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
BRAF P15056 2/20 0.41
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
GAA P10253 1/20 0.39
RAB9A P51151 1/20 0.39
MAPT P10636 3/20 0.39
ALDH1A1 P00352 1/20 0.38
HSP90AA1 P07900 1/20 0.38
MAPK1 P28482 1/20 0.38
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
CA12 O43570 1/20 0.38
CA9 Q16790 1/20 0.38

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
SCHEMBL6720790 0.88 SIRT2 (0.43) LMNASMN1; SMN2MEN1KMT2ARAB9A
SCHEMBL8523992 0.78 TNNI3K (0.38) TNNI3KLMNAPTBP1EGFRBRAF
SCHEMBL8556316 0.78 POLB (0.51) TNNI3KLMNAPTBP1MEN1KMT2A
SCHEMBL6720893 0.75 MAPT (0.46) SMN1; SMN2MEN1KMT2AGAARAB9A
SCHEMBL6728881 0.75 SIGMAR1 (0.48) SMN1; SMN2GAARAB9AMAPTALDH1A1
Hydrochloric Acid SCHEMBL7202744 0.74 SIGMAR1 (0.50) SMN1; SMN2GAARAB9AMAPTALDH1A1
SCHEMBL4151992 0.74 LMNA (0.52) TNNI3KLMNAPTBP1EGFRSMN1; SMN2
SCHEMBL6728090 0.73 MEN1 (0.34) LMNASMN1; SMN2MEN1KMT2AGAA
SCHEMBL6728898 0.73 GRIK1 (0.58) MEN1KMT2AGAARAB9AMAPT
SCHEMBL264637 0.71 TNNI3K (0.60) TNNI3KLMNAEGFRSMN1; SMN2GAA

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
EP-0918460-A1 METHODS OF TREATMENT OF EYE TRAUMA AND DISORDERS CAMBRIDGE NEUROSCIENCE, INC. (US) 1999-06-02 EP disclosed
WO-1998004131-A1 METHODS OF TREATMENT OF EYE TRAUMA AND DISORDERS CAMBRIDGE NEUROSCIENCE, INC. (US) 1998-02-05 WO disclosed