SCHEMBL20573270

SCHEMBL20573270

NC(=O)Oc1ccccc1-c1ccc(F)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 1/20 0.50
SLC6A3 Q01959 1/20 0.50
PTGS2 P35354 2/20 0.46
PTGS1 P23219 2/20 0.46
GRM2 Q14416 1/20 0.43
CHRNB2 P17787 1/20 0.42
CHRNB4 P30926 1/20 0.42
CHRNA3 P32297 1/20 0.42
CHRNA4 P43681 1/20 0.42
FABP7 O15540 1/20 0.42
FABP3 P05413 1/20 0.42
FABP5 Q01469 1/20 0.42
TUBB4A P04350 2/20 0.42
TUBB P07437 2/20 0.42
TUBA3C P0DPH7 2/20 0.42
TUBA1B P68363 2/20 0.42
TUBA4A P68366 2/20 0.42
TUBB4B P68371 2/20 0.42
TUBB3 Q13509 2/20 0.42
TUBB2A Q13885 2/20 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
SCHEMBL274364 0.87 FABP3 (0.53) FABP7FABP3FABP5ALDH1A1LMNA
SCHEMBL31448682 0.87 FABP3 (0.49) FABP7FABP3FABP5ALDH1A1LMNA
SCHEMBL17796956 0.86 PTGER1 (0.43) SLC6A4SLC6A3FABP7FABP3FABP5
SCHEMBL27469798 0.86 NCOA1 (0.50) SLC6A4SLC6A3FABP7FABP3FABP5
SCHEMBL17796918 0.84 SLC6A4 (0.49) SLC6A4SLC6A3PTGS2PTGS1FABP7
SCHEMBL20573268 0.84 BCL9 (0.40) SLC6A4SLC6A3PTGS1GRM2
SCHEMBL7647143 0.84 LMNA (0.50) SLC6A4SLC6A3FABP7FABP3FABP5
SCHEMBL27615625 0.84 MKNK1 (0.49) PTGS1ALDH1A1MAPT
SCHEMBL20573269 0.83 TUBB4A (0.44) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL29177407 0.83 FEN1 (0.50) PTGS2PTGS1LMNAMAPTHTR2C

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
EP-3029026-B1 NOVEL BIPHENYL DERIVATIVE AND METHOD FOR PREPARING SAME DONG A ST CO LTD (KR) 2018-12-05 EP claimed