SCHEMBL3882170

SCHEMBL3882170

Cc1noc(C)c1C(=O)NOc1cccc(C(F)(F)F)c1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 2/20 0.52
EPAS1 Q99814 4/20 0.47
LMNA P02545 1/20 0.47
POLB P06746 1/20 0.45
MAPT P10636 1/20 0.45
KMT2A Q03164 1/20 0.45
FLT1 P17948 1/20 0.44
KDR P35968 1/20 0.44
ALDH1A1 P00352 1/20 0.44
TSHR P16473 1/20 0.43
HTT P42858 1/20 0.43
GAA P10253 1/20 0.43
BRD4 O60885 1/20 0.43
KDM4E B2RXH2 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL3992388 0.85 TSHR (0.46) RXFP1LMNAKMT2AFLT1KDR
SCHEMBL3885508 0.79 RAB9A (0.55) RXFP1LMNAMAPTALDH1A1HTT
SCHEMBL3880466 0.74 GAA (0.54) EPAS1LMNAKMT2AALDH1A1GAA
SCHEMBL1808833 0.73 CYP3A4 (0.54) RXFP1KMT2ASMN1; SMN2
SCHEMBL16707356 0.72 ADORA3 (0.52) RXFP1LMNAPOLBMAPTKMT2A
SCHEMBL6707794 0.71 GFER (0.65) LMNAKMT2AFLT1KDRALDH1A1
SCHEMBL8441802 0.71 TLR7 (0.62) MAPTKMT2AKDM4E
SCHEMBL13734246 0.69 GPBAR1 (0.61) EPAS1LMNAPOLBMAPTKMT2A
SCHEMBL11420447 0.69 GPBAR1 (0.61) EPAS1POLBMAPTKMT2AALDH1A1
SCHEMBL29059158 0.69 EPAS1 (0.74) RXFP1EPAS1LMNAPOLBMAPT

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2010507-A2 NOVEL ISOOXAZOLE DERIVATIVES AND THEIR USES ScheBo Biotech Aktiengesellschaft (DE) 2009-01-07 EP claimed
WO-2007110068-A2 NOVEL ISOOXAZOLE DERIVATIVES AND THEIR USES SCHEBO BIOTECH AG (DE) 2007-10-04 WO claimed
EP-2010507-A2 NOVEL ISOOXAZOLE DERIVATIVES AND THEIR USES ScheBo Biotech Aktiengesellschaft (DE) 2009-01-07 EP disclosed
WO-2007110068-A2 NOVEL ISOOXAZOLE DERIVATIVES AND THEIR USES SCHEBO BIOTECH AG (DE) 2007-10-04 WO disclosed