SCHEMBL10547136

SCHEMBL10547136

CC(=O)c1ccc(C(=O)N(C)CCCc2ccccc2C)o1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.48
▸ BCHE P06276 2/20 0.40
▸ ACHE P22303 2/20 0.40
▸ KMT2A Q03164 3/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ USP2 O75604 1/20 0.39
▸ MAOB P27338 1/20 0.38
▸ LMNA P02545 1/20 0.37
▸ HSD17B1 P14061 2/20 0.36
▸ HSD17B2 P37059 1/20 0.36
▸ HSP90AA1 P07900 1/20 0.36
▸ NAMPT P43490 1/20 0.35

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
SCHEMBL10546770 0.88 ALDH1A1 (0.45) ALDH1A1BCHEACHEKMT2AMEN1
SCHEMBL10546055 0.79 MLYCD (0.51) ALDH1A1KMT2ALMNA
SCHEMBL10544258 0.76 ALDH1A1 (0.47) ALDH1A1KMT2AMEN1MAOBLMNA
SCHEMBL16921569 0.70 TYMP (0.46) ALDH1A1MAOBLMNA
SCHEMBL13381405 0.68 ALDH1A1 (0.42) ALDH1A1KMT2AMEN1USP2LMNA
SCHEMBL23347674 0.68 TSHR (0.49) ALDH1A1KMT2AMEN1LMNA
SCHEMBL10544541 0.68 SMN1; SMN2 (0.43) ALDH1A1KMT2AMEN1LMNA
SCHEMBL14541578 0.66 MAOB (0.58) ALDH1A1KMT2AMAOBLMNA
SCHEMBL10543666 0.66 ALDH1A1 (0.55) ALDH1A1KMT2AMEN1LMNAHSP90AA1
SCHEMBL10544372 0.66 RIPK1 (0.51) LMNA

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-4814341-A HISTAMINE H2 ANTAGONISTS REITER LAWRENCE A (US) 1989-03-21 — — US disclosed
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