SCHEMBL30148747

SCHEMBL30148747

C#Cc1cccc(Oc2cccc(C#C)c2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HAO1 Q9UJM8 1/20 0.50
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA9 Q16790 1/20 0.44
CA14 Q9ULX7 1/20 0.44
FABP7 O15540 1/20 0.43
FABP5 Q01469 1/20 0.43
MEN1 O00255 1/20 0.41
MITF O75030 1/20 0.41
ALDH1A1 P00352 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
GFER P55789 1/20 0.41
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NLRP1 Q9C000 1/20 0.41
NOD2 Q9HC29 1/20 0.41
MAOB P27338 1/20 0.40
CYP1A1 P04798 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
SCHEMBL3838122 1.00 HAO1 (0.50) HAO1CA12CA1CA2CA9
SCHEMBL10970729 0.98 HAO1 (0.49) HAO1CA12CA1CA2CA9
SCHEMBL5689227 0.94 LTA4H (0.50) HAO1CA12CA1CA2CA9
SCHEMBL3840668 0.92 HAO1 (0.46) HAO1CA12CA1CA2CA9
SCHEMBL10733771 0.92 HAO1 (0.49) HAO1FABP7FABP5MEN1MITF
SCHEMBL10566143 0.88 HAO1 (0.43) HAO1CA12CA1CA2CA9
SCHEMBL11796684 0.88 AR (0.44) HAO1FABP7FABP5MEN1KMT2A
SCHEMBL9817776 0.88 MAOB (0.60) HAO1CA12CA1CA2CA9
SCHEMBL4523103 0.88 SMN1; SMN2 (0.53) HAO1CA12CA1CA2CA9
SCHEMBL11513520 0.87 ALDH1A1 (0.66) HAO1CA12CA1CA2CA9

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-110246974-B Organic light emitting device and flat panel display apparatus including the same 三星显示有限公司 2023-01-24 CN disclosed