SCHEMBL1670517

SCHEMBL1670517

Cc1noc(C)c1-n1c(C(N)=NO)c(C)c(Br)c1-c1ccc(O)c(F)c1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 2/20 0.33
ESR1 P03372 5/20 0.33
ESR2 Q92731 5/20 0.33
MGLL Q99685 3/20 0.33
TTR P02766 1/20 0.32
MIF P14174 1/20 0.31
ERN1 O75460 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
SCHEMBL1670323 0.86 BRD4 (0.30)
SCHEMBL1670324 0.86 BRD4 (0.30)
SCHEMBL1670515 0.84 ESR1 (0.33) ESR1ESR2TTRMIFERN1
SCHEMBL1671019 0.81 KDM1A (0.35) KDM1AESR1ESR2MGLLTTR
SCHEMBL1671022 0.81 KDM1A (0.35) KDM1AESR1ESR2MGLLTTR
SCHEMBL12800991 0.74 BRD4 (0.32)
SCHEMBL1670941 0.74 BRD4 (0.32)
SCHEMBL1670939 0.74 BRD4 (0.32)
SCHEMBL1671028 0.71 BRD4 (0.31)
SCHEMBL1671032 0.71 BRD4 (0.31)

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
WO-2011042477-A1 SUBSTITUTED PYRROLES AND IMIDAZOLES AS ESTROGEN RECEPTOR LIGANDS KARO BIO AB (SE) 2011-04-14 WO claimed