SCHEMBL8983546

SCHEMBL8983546

O=C1c2ccccc2C(=O)N1CCOc1ccc(-c2nc3ccccc3o2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 4/20 0.61
▸ NPC1 O15118 3/20 0.61
▸ MEN1 O00255 2/20 0.61
▸ KMT2A Q03164 2/20 0.61
▸ HPGD P15428 2/20 0.61
▸ KDM4E B2RXH2 1/20 0.61
▸ ALDH1A1 P00352 1/20 0.61
▸ MAPT P10636 1/20 0.61
▸ PPARG P37231 1/20 0.61
▸ NCOA2 Q15596 1/20 0.61
▸ NCOA1 Q15788 1/20 0.61
▸ SMN1; SMN2 Q16637 1/20 0.61
▸ TLR9 Q9NR96 1/20 0.60
▸ THRB P10828 1/20 0.57
▸ ALOX15 P16050 1/20 0.57
▸ HSD17B10 Q99714 1/20 0.57
▸ CHRNB4 P30926 1/20 0.56
▸ CHRNA3 P32297 1/20 0.56
▸ CHRNA7 P36544 1/20 0.56
▸ CHRNA10 Q9GZZ6 1/20 0.56

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
SCHEMBL8983392 0.94 TLR9 (0.65) RAB9ANPC1MEN1KMT2AHPGD
SCHEMBL29237869 0.79 HPGD (0.79) RAB9ANPC1MEN1KMT2AHPGD
SCHEMBL31030951 0.79 HPGD (0.79) RAB9ANPC1MEN1KMT2AHPGD
SCHEMBL11137597 0.79 CHRNB4 (0.67) RAB9ANPC1MEN1KMT2AHPGD
SCHEMBL4905018 0.77 HPGD (0.74) RAB9ANPC1KMT2AHPGDALDH1A1
SCHEMBL9397383 0.76 TLR9 (0.66) RAB9ANPC1MEN1KMT2AHPGD
Hydrochloric Acid SCHEMBL8983461 0.76 CHRNB4 (0.64) RAB9ANPC1MEN1KMT2AHPGD
Hydrochloric Acid SCHEMBL8983457 0.75 TLR9 (0.65) RAB9ANPC1MEN1KMT2AHPGD
SCHEMBL12432236 0.74 CHRNB4 (0.68) RAB9ANPC1MEN1KMT2AHPGD
SCHEMBL19989658 0.74 TLR9 (0.63) RAB9ANPC1MEN1KMT2AHPGD

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
US-5561143-A ANTICHOLESTEROL AGENTS, ANTILIPEMIC AGENTS RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1996-10-01 — — US disclosed
US-5534532-A ANTICHOLESTEROL AGENTS, SQUALENE SYNTHASE INHIBITOR RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1996-07-09 — — US disclosed
US-5455260-A Anticholesterol agents; reduction of serum cholesterol without reducing mevalonic metabolite synthesis; side effect RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1995-10-03 — — US disclosed
WO-1994027601-A1 ALIPHATIC AMINO BIS-ARYL SQUALENE SYNTHASE INHIBITORS RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1994-12-08 — — WO disclosed
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