SCHEMBL8156090

SCHEMBL8156090

c1ccc(N(c2ccccc2)c2ccoc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.44
TDP1 Q9NUW8 3/20 0.44
MAPT P10636 3/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
CYP1A2 P05177 2/20 0.44
CYP3A4 P08684 2/20 0.44
CYP2D6 P10635 2/20 0.44
CYP2C19 P33261 2/20 0.44
KDM4E B2RXH2 1/20 0.44
CYP2C9 P11712 1/20 0.44
MEN1 O00255 4/20 0.38
KMT2A Q03164 4/20 0.38
CRHBP P24387 1/20 0.38
ATM Q13315 1/20 0.38
CRHR2 Q13324 1/20 0.38
TLR9 Q9NR96 1/20 0.38
ALOX15 P16050 2/20 0.31
NPSR1 Q6W5P4 1/20 0.31
HSD17B10 Q99714 1/20 0.31
TSHR P16473 3/20 0.30

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
Furan SCHEMBL14811407 0.77 ALDH1A1 (0.50) ALDH1A1TDP1MAPTL3MBTL1CYP1A2
Benzene SCHEMBL28083527 0.76 ALDH1A1 (0.67) ALDH1A1TDP1MAPTL3MBTL1CYP1A2
SCHEMBL453160 0.76 ALDH1A1 (0.67) ALDH1A1TDP1MAPTL3MBTL1CYP1A2
SCHEMBL9490577 0.76 ALDH1A1 (0.67) ALDH1A1TDP1MAPTL3MBTL1CYP1A2
SCHEMBL30959 0.76 ALDH1A1 (0.67) ALDH1A1TDP1MAPTL3MBTL1CYP1A2
Methane SCHEMBL23501806 0.73 ALDH1A1 (0.63) ALDH1A1TDP1MAPTL3MBTL1CYP1A2
SCHEMBL8404848 0.73 ALDH1A1 (0.63) ALDH1A1TDP1MAPTL3MBTL1CYP1A2
Bromide SCHEMBL3328197 0.73 ALDH1A1 (0.63) ALDH1A1TDP1MAPTL3MBTL1CYP1A2
Hydrochloric Acid SCHEMBL2138441 0.73 ALDH1A1 (0.63) ALDH1A1TDP1MAPTL3MBTL1CYP1A2
Ammonia Solution, Strong SCHEMBL20336769 0.73 ALDH1A1 (0.63) ALDH1A1TDP1MAPTL3MBTL1CYP1A2

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
JP-2000319273-A PRODUCTION OF (DIARYLAMINO)FURAN TOSOH CORP 2000-11-21 JP disclosed