SCHEMBL10280624

SCHEMBL10280624

Bc1csc(C2CC(=O)Nc3c2ccc2ccccc32)c1

nearest known ligand 0.67

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.60
▸ HSD17B10 Q99714 1/20 0.55
▸ MAPT P10636 3/20 0.53
▸ SMN1; SMN2 Q16637 2/20 0.53
▸ HTT P42858 1/20 0.53
▸ ALDH1A1 P00352 3/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ MAPK1 P28482 1/20 0.49
▸ TDP1 Q9NUW8 1/20 0.49
▸ IDO1 P14902 3/20 0.46
▸ TP53 P04637 6/20 0.41
▸ POLB P06746 1/20 0.40
▸ MTNR1A P48039 1/20 0.35
▸ SIRT2 Q8IXJ6 1/20 0.34

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
SCHEMBL880251 0.87 LMNA (0.61) LMNAHSD17B10MAPTSMN1; SMN2HTT
SCHEMBL880385 0.81 LMNA (0.65) LMNAHSD17B10MAPTSMN1; SMN2HTT
SCHEMBL880307 0.77 IDO1 (0.70) LMNAHSD17B10MAPTSMN1; SMN2HTT
SCHEMBL880369 0.76 LMNA (0.59) LMNAHSD17B10MAPTSMN1; SMN2HTT
SCHEMBL880243 0.76 LMNA (0.59) LMNAHSD17B10MAPTSMN1; SMN2HTT
SCHEMBL880257 0.76 LMNA (0.59) LMNAHSD17B10MAPTSMN1; SMN2HTT
SCHEMBL852442 0.76 LMNA (0.72) LMNAHSD17B10MAPTSMN1; SMN2HTT
SCHEMBL880224 0.75 TP53 (0.62) LMNAHSD17B10MAPTSMN1; SMN2HTT
SCHEMBL880435 0.75 MAPT (0.68) LMNAHSD17B10MAPTSMN1; SMN2HTT
SCHEMBL880496 0.75 LMNA (0.61) LMNAHSD17B10MAPTSMN1; SMN2HTT

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
EP-2433634-A2 Compounds, compositions and methods of inhibiting a-synuclein toxicity The Whitehead Institute for Biomedical Research (US) 2012-03-28 — — EP disclosed
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