SCHEMBL6985168

SCHEMBL6985168

CSc1ccc2c(c1)N(CCCl)S(=O)(=O)N(C(C)C)C2

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.40
HTR2C P28335 1/20 0.40
HTR2B P41595 1/20 0.40
KDM4E B2RXH2 1/20 0.30
PKM P14618 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL8316061 0.83 CRY1 (0.35)
SCHEMBL8318057 0.81 KDM4E (0.39) KDM4EPKML3MBTL1
SCHEMBL6982495 0.80 KCNH2 (0.32)
SCHEMBL8317165 0.74 SLC6A2 (0.39) KDM4EPKML3MBTL1
SCHEMBL8316696 0.73 SLC6A2 (0.38) KDM4EPKML3MBTL1
SCHEMBL6984197 0.72 KDM4E (0.41) KDM4E
SCHEMBL6984303 0.72 BRD4 (0.32) HTR2C
SCHEMBL7081764 0.72
SCHEMBL8317987 0.72 ADRA2A (0.36) KDM4EPKML3MBTL1
SCHEMBL8318169 0.70 SLC6A2 (0.34)

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