SCHEMBL6985370

SCHEMBL6985370

CC(C)N1Cc2cc(CO)ccc2NS1(=O)=O

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 4/20 0.32
KDM4E B2RXH2 1/20 0.31
RECQL P46063 1/20 0.31
SYK P43405 1/20 0.31
SDCBP O00560 1/20 0.30
SDC2 P34741 1/20 0.30
MAPT P10636 1/20 0.30
RAB9A P51151 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
SCHEMBL6984360 0.79
SCHEMBL8318662 0.79 DPP8 (0.36) KDM4ERECQL
SCHEMBL6490844 0.77 KDM4E (0.35) KDM4ERECQLSYKMAPTRAB9A
SCHEMBL6492438 0.76 BRD4 (0.38) KDM4ERECQL
SCHEMBL2603740 0.76 KDM4E (0.47) KDM4ERECQL
SCHEMBL4460457 0.66 CHKA (0.38) RAB9A
SCHEMBL8489586 0.63 CA12 (0.43) KDM4ERECQL
SCHEMBL8315757 0.63 CA12 (0.36) KDM4ERECQL
SCHEMBL2255811 0.62 NAMPT (0.43) NAMPT
SCHEMBL28641279 0.61 HRH3 (0.44) NAMPT

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