SCHEMBL8955697

SCHEMBL8955697

CCC(C)CCOCCCCCCCCO

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ THRB P10828 1/20 0.45
▸ HTT P42858 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ TSHR P16473 2/20 0.40
▸ GAA P10253 1/20 0.38
▸ CYP4F2 P78329 1/20 0.38
▸ CYP4A11 Q02928 1/20 0.38
▸ USP2 O75604 1/20 0.36
▸ LMNA P02545 2/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ ACHE P22303 6/20 0.33
▸ SPHK1 Q9NYA1 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL13234985 0.88 HTT (0.45) MEN1KMT2ATHRBHTTMAPT
SCHEMBL13346947 0.84 MEN1 (0.55) MEN1KMT2ATHRBHTTMAPT
SCHEMBL7952267 0.83 TSHR (0.48) MEN1KMT2ATHRBHTTMAPT
SCHEMBL5791596 0.82 USP2 (0.46) MEN1KMT2ATHRBHTTMAPT
SCHEMBL5791593 0.82 USP2 (0.46) MEN1KMT2ATHRBHTTMAPT
SCHEMBL5793799 0.82 USP2 (0.46) MEN1KMT2ATHRBHTTMAPT
SCHEMBL5793793 0.82 USP2 (0.46) MEN1KMT2ATHRBHTTMAPT
SCHEMBL11735533 0.81 MEN1 (0.45) MEN1KMT2ATHRBHTTMAPT
SCHEMBL11737353 0.81 MEN1 (0.45) MEN1KMT2ATHRBHTTMAPT
SCHEMBL13224991 0.81 HTT (0.45) MEN1KMT2ATHRBHTTMAPT

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1039326-C Phosphinyloxy propanaminium inner salt derivatives SANDOZ LTD (CH) 1998-07-29 — — CN disclosed
US-5516767-A PRODRUG AS HYPOGLYCEMIC AGENT SANDOZ LTD. (CH) 1996-05-14 — — US disclosed
US-5412137-A Hypoglycemic agents SANDOZ LTD. (CH) 1995-05-02 — — US disclosed
CN-1086217-A The derivative of Phosphinyloxy propanaminium inner salt SANDOZ LTD (CH) 1994-05-04 — — CN disclosed
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