SCHEMBL6980884

SCHEMBL6980884

CN1c2cc(S(C)(=O)=O)ccc2N(CC=O)S1(=O)=O

nearest known ligand 0.36

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 2/20 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
SCHEMBL7948146 0.86 PTGS2 (0.32) BRD4
SCHEMBL6974957 0.77 SMN1; SMN2 (0.33)
SCHEMBL6527029 0.74 BRD4 (0.33) BRD4
SCHEMBL6527027 0.66 KCNH2 (0.34) BRD4
SCHEMBL7948151 0.64 LMNA (0.36) BRD4
SCHEMBL6502022 0.63 MEN1 (0.41)
SCHEMBL31016286 0.62 NPBWR1 (0.38) BRD4
SCHEMBL28347309 0.60 LRRK2 (0.41)
SCHEMBL7821251 0.59 ENPP2 (0.35) BRD4
SCHEMBL1428902 0.57 ENPP2 (0.48)

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-1131321-B1 INDOLE DERIVATIVES AND THEIR USE AS SEROTONIN RECEPTOR LIGANDS LILLY CO ELI (GB) 2003-09-10 EP disclosed
US-6329366-B1 HETEROCYCLIC, PIPERIDINE, INDOLE DERIVITIVES FOR TREATMENT OF NERVOUS SYSTEM DISORDERS AND SEROTONIN ANTAGONIST ELI LILLY AND COMPANY LIMITED (GB) 2001-12-11 US disclosed