SCHEMBL8486473

SCHEMBL8486473

C=C1SC(=O)N(c2ccccc2OCC(C)NCc2nc(-c3ccccc3)oc2C)C1=O

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARG P37231 10/20 0.39
PPARA Q07869 8/20 0.39
LMNA P02545 2/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
MAPT P10636 1/20 0.35
USP2 O75604 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
TP53 P04637 1/20 0.35
RAB9A P51151 1/20 0.34

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
SCHEMBL8486705 0.68 PPARG (0.39) PPARGPPARALMNAKDM4EMAPT
SCHEMBL8486801 0.68 NPC1 (0.34) LMNAKDM4EMEN1KMT2ASMN1; SMN2
SCHEMBL3761024 0.62 KDM4E (0.58) PPARGPPARALMNAKDM4EMAPT
SCHEMBL9316924 0.62 KDM4E (0.60) PPARGPPARALMNAKDM4EMAPT
SCHEMBL10447399 0.60 KDM4E (0.57) PPARGPPARALMNAKDM4EMAPT
SCHEMBL10202989 0.59 KDM4E (0.60) PPARGPPARALMNAKDM4ERAB9A
SCHEMBL1596084 0.59 KDM4E (0.64) PPARGPPARALMNAKDM4EMEN1
SCHEMBL6385812 0.59 PPARA (0.57) PPARGPPARALMNAKDM4EMAPT
SCHEMBL4029878 0.58 KDM4E (0.52) PPARGPPARALMNAKDM4EMAPT
SCHEMBL6157744 0.58 FFAR1 (0.53) PPARGPPARAKDM4EMAPTSMN1; SMN2

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
US-5925656-A CONTAINING A 2,4-DIOXOTRIAZOLIDINE RING DR. REDDY'S RESEARCH FOUNDATION (IN) 1999-07-20 US disclosed