SCHEMBL28837155

SCHEMBL28837155

Cc1cccc(-c2c(CC(F)(F)F)oc3ccccc23)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.47
KMT2A Q03164 3/20 0.45
MEN1 O00255 2/20 0.45
ATM Q13315 2/20 0.45
RCE1 Q9Y256 2/20 0.45
MAPT P10636 3/20 0.42
ENPP1 P22413 1/20 0.40
HPGD P15428 2/20 0.38
TP53 P04637 2/20 0.38
CYP3A4 P08684 2/20 0.38
MAPK1 P28482 2/20 0.38
ALDH1A1 P00352 2/20 0.38
KDM4E B2RXH2 1/20 0.38
HSD17B10 Q99714 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
PTPN1 P18031 3/20 0.38
NPC1 O15118 1/20 0.37
TSHR P16473 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL29927092 1.00 L3MBTL1 (0.47) L3MBTL1KMT2AMEN1ATMRCE1
SCHEMBL28837163 0.85 PTPN1 (0.46) L3MBTL1MAPTHPGDTP53ALDH1A1
SCHEMBL29926945 0.85 PTPN1 (0.46) L3MBTL1MAPTHPGDTP53ALDH1A1
SCHEMBL28837150 0.84 MAPT (0.52) L3MBTL1MAPTHPGDTP53CYP3A4
SCHEMBL29927513 0.84 MAPT (0.52) L3MBTL1MAPTHPGDTP53CYP3A4
SCHEMBL29927630 0.84 GABRP (0.47) KMT2AMEN1MAPTTP53PTPN1
SCHEMBL28837160 0.84 GABRP (0.47) KMT2AMEN1MAPTTP53PTPN1
SCHEMBL29926823 0.82 L3MBTL1 (0.47) L3MBTL1KMT2AMEN1MAPTHPGD
SCHEMBL28837152 0.82 L3MBTL1 (0.60) L3MBTL1KMT2AMEN1ATMMAPT
SCHEMBL28837162 0.82 L3MBTL1 (0.47) L3MBTL1KMT2AMEN1MAPTHPGD

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
CN-115043802-A Synthesis method of trifluoroethyl benzofuran compound 温州大学 2022-09-13 CN disclosed