SCHEMBL9593922

SCHEMBL9593922

CC(=O)Oc1c(C=O)c(C)nn1-c1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.67
▸ ALDH1A1 P00352 2/20 0.60
▸ HPGD P15428 1/20 0.60
▸ HTT P42858 2/20 0.56
▸ MAPT P10636 6/20 0.46
▸ POLB P06746 2/20 0.46
▸ NPSR1 Q6W5P4 2/20 0.46
▸ RAB9A P51151 2/20 0.46
▸ ALOX15 P16050 1/20 0.46
▸ GAA P10253 3/20 0.45
▸ TP53 P04637 2/20 0.45
▸ RECQL P46063 1/20 0.45
▸ NPY1R P25929 1/20 0.45
▸ NPY2R P49146 1/20 0.45
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ APEX1 P27695 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ NPC1 O15118 1/20 0.44
▸ MEN1 O00255 2/20 0.44

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
SCHEMBL11487535 0.82 LMNA (0.74) LMNAALDH1A1HPGDHTTMAPT
SCHEMBL5928922 0.80 LMNA (0.70) LMNAALDH1A1HTTMAPTPOLB
Acetic Acid SCHEMBL9593918 0.78 LMNA (0.56) LMNAALDH1A1HPGDHTTMAPT
SCHEMBL5928913 0.77 LMNA (0.58) LMNAALDH1A1HPGDHTTMAPT
SCHEMBL8883561 0.76 LMNA (0.60) LMNAALDH1A1HTTMAPTPOLB
SCHEMBL1779819 0.76 HTT (0.64) LMNAALDH1A1HTTMAPTPOLB
SCHEMBL29956682 0.73 LMNA (0.60) LMNAALDH1A1HTTMAPTPOLB
SCHEMBL1267498 0.73 SMN1; SMN2 (0.66) LMNAALDH1A1HPGDHTTMAPT
SCHEMBL3835167 0.73 HTT (0.64) LMNAALDH1A1HTTMAPTPOLB
SCHEMBL8883850 0.73 LMNA (0.60) LMNAALDH1A1HTTMAPTPOLB

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
US-5240947-A Thrombocyte aggregation inhibitors, antiallergens NATIONAL SCIENCE COUNCIL (TW) 1993-08-31 — — US disclosed
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