SCHEMBL3483668

SCHEMBL3483668

C[C@@](O)(CNC(=O)OCc1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 1/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
TACR1 P25103 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
LMNA P02545 1/20 0.47
PTGDR2 Q9Y5Y4 1/20 0.46
HTT P42858 1/20 0.45
GPBAR1 Q8TDU6 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL3484534 0.88 SMN1; SMN2 (0.47) MGLLMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL15677565 0.81 SMN1; SMN2 (0.56) MEN1KMT2ASMN1; SMN2LMNAHTT
SCHEMBL2371661 0.80 MEN1 (0.58) MEN1KMT2ASMN1; SMN2LMNAHTT
SCHEMBL18002248 0.80 SMN1; SMN2 (0.58) MEN1KMT2ASMN1; SMN2LMNAHTT
SCHEMBL8149899 0.78 LMNA (0.59) MEN1KMT2ASMN1; SMN2LMNAHTT
SCHEMBL13741500 0.78 SMN1; SMN2 (0.59) MEN1KMT2ASMN1; SMN2LMNAHTT
SCHEMBL26293786 0.77 TACR1 (0.48) MGLLMEN1KMT2ATACR1SMN1; SMN2
SCHEMBL10263314 0.76 SMN1; SMN2 (0.54) MEN1KMT2ASMN1; SMN2LMNAHTT
SCHEMBL2192192 0.76 SMN1; SMN2 (0.56) SMN1; SMN2LMNAHTTL3MBTL1
SCHEMBL2271998 0.76 LMNA (0.56) MEN1KMT2ASMN1; SMN2LMNAHTT

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-2257536-A2 CYCLIC DIARYL ETHER AS ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS Amira Pharmaceuticals, Inc. (US) 2010-12-08 EP disclosed
WO-2009102893-A2 CYCLIC DIARYL ETHER COMPOUNDS AS ANTAGONISTS OF PROSTAGLANDIN D2 receptors AMIRA PHARMACEUTICALS, INC. (US) 2009-08-20 WO disclosed