SCHEMBL21746019

SCHEMBL21746019

CS(=O)(=O)CNc1ccc(Br)nn1

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 1/20 0.39
LMNA P02545 1/20 0.33
CYP2C19 P33261 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL21746093 0.80 LMNA (0.33) LMNACYP2C19SMN1; SMN2
SCHEMBL21746022 0.79 KDM4E (0.47) EDNRALMNASMN1; SMN2
SCHEMBL1858705 0.66
SCHEMBL16430495 0.65 EDNRA (0.32) EDNRA
SCHEMBL13356959 0.64 IDH1 (0.44)
SCHEMBL21746025 0.63 EDNRA (0.34) EDNRA
SCHEMBL29451087 0.63
SCHEMBL610831 0.63
SCHEMBL3132342 0.62 NNMT (0.59) SMN1; SMN2
SCHEMBL4978865 0.60 CA2 (0.61) LMNA

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-2944637-B1 NITROGEN-CONTAINING HETEROCYLIC COMPOUND OR SALT THEREOF FUJIFILM CORP (JP) 2020-02-19 EP disclosed