SCHEMBL9218480

SCHEMBL9218480

ON=Cc1cccc(Oc2cccc(C(F)(F)F)c2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GCGR P47871 1/20 0.51
ALDH1A1 P00352 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
POLB P06746 1/20 0.46
EPOR P19235 1/20 0.45
RECQL P46063 1/20 0.44
MAOB P27338 1/20 0.42
AOC3 Q16853 1/20 0.42
MEN1 O00255 3/20 0.41
MAPT P10636 3/20 0.41
KMT2A Q03164 3/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
KDM4E B2RXH2 3/20 0.41
LTA4H P09960 1/20 0.41
KIF11 P52732 1/20 0.41
HTT P42858 1/20 0.40
TEAD1 P28347 1/20 0.40
KLF5 Q13887 1/20 0.40

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
SCHEMBL9218471 1.00 GCGR (0.51) GCGRALDH1A1L3MBTL1POLBEPOR
SCHEMBL2165184 0.85 RECQL (0.55) ALDH1A1L3MBTL1RECQLMEN1MAPT
SCHEMBL746313 0.85 RECQL (0.55) ALDH1A1L3MBTL1RECQLMEN1MAPT
SCHEMBL746312 0.85 RECQL (0.55) ALDH1A1L3MBTL1RECQLMEN1MAPT
SCHEMBL7237043 0.85 GCGR (0.48) GCGRALDH1A1L3MBTL1POLBEPOR
Methylamine SCHEMBL9389458 0.81 RECQL (0.55) RECQLMEN1MAPTKMT2ANPC1
SCHEMBL10888892 0.80 MAPT (0.55) ALDH1A1L3MBTL1POLBEPORMEN1
SCHEMBL9325994 0.80 MAPT (0.55) ALDH1A1L3MBTL1POLBEPORMEN1
SCHEMBL9325989 0.80 MAPT (0.55) ALDH1A1L3MBTL1POLBEPORMEN1
SCHEMBL9798371 0.80 LTA4H (0.54) ALDH1A1L3MBTL1POLBMAOBAOC3

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-0636124-A1 3,4-DIHYDRO-2H-1,2,4-BENZOTHIADIAZINE-1,1-DIOXIDE-3-CARBOXYLIC ACID DERIVATIVES, PREPARATION THEREOF AND DRUGS CONTAINING SAME Aventis Pharma S.A. (FR) 1995-02-01 EP disclosed
WO-1993021170-A1 3,4-DIHYDRO-2H-1,2,4-BENZOTHIADIAZINE-1,1-DIOXIDE-3-CARBOXYLIC ACID DERIVATIVES, PREPARATION THEREOF AND DRUGS CONTAINING SAME RHONE-POULENC RORER S.A. (FR) 1993-10-28 WO disclosed