SCHEMBL9170607

SCHEMBL9170607

O=C(NC(=O)C1CCCO1)c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 2/20 0.60
▸ L3MBTL1 Q9Y468 1/20 0.58
▸ HPGD P15428 4/20 0.56
▸ GAA P10253 2/20 0.56
▸ POLB P06746 4/20 0.55
▸ ALDH1A1 P00352 3/20 0.54
▸ CYP2C19 P33261 1/20 0.54
▸ GLA P06280 1/20 0.54
▸ ALOX12 P18054 1/20 0.54
▸ RAB9A P51151 2/20 0.53
▸ NPC1 O15118 1/20 0.53
▸ TP53 P04637 1/20 0.53
▸ TDP1 Q9NUW8 1/20 0.52
▸ HSD17B10 Q99714 1/20 0.51
▸ MEN1 O00255 2/20 0.50
▸ KMT2A Q03164 2/20 0.50
▸ PKM P14618 1/20 0.50

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
SCHEMBL27351823 0.78 HPGD (0.51) HTTL3MBTL1HPGDGAAPOLB
SCHEMBL8562439 0.76 HPGD (0.49) HTTHPGDGAAPOLBALDH1A1
SCHEMBL14963911 0.76 RAB9A (0.73) HTTL3MBTL1HPGDPOLBALDH1A1
SCHEMBL18467908 0.75 NPC1 (0.64) HTTL3MBTL1HPGDPOLBALDH1A1
SCHEMBL20592916 0.74 L3MBTL1 (0.47) HTTL3MBTL1HPGDGAAPOLB
SCHEMBL28688894 0.74 HPGD (0.57) HTTL3MBTL1HPGDGAAALDH1A1
SCHEMBL16644094 0.74 PKM (0.67) HTTL3MBTL1HPGDGAAPOLB
SCHEMBL14963935 0.74 HTT (0.63) HTTL3MBTL1HPGDPOLBALDH1A1
SCHEMBL28523792 0.74 HTT (0.49) HTTL3MBTL1HPGDGAAPOLB
SCHEMBL169922 0.73 MCL1 (0.49) HTTL3MBTL1HPGDGAAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0483714-B1 A method of preparing an acid additional salt of delta-aminolevulinic acid JAPAN TOBACCO INC (JP) 1995-05-03 — — EP disclosed
US-5284973-A Method of preparing an acid additional salt of delta-aminolevulinic acid JAPAN TOBACCO INC. (JP) 1994-02-08 — — US disclosed
EP-0483714-A1 A method of preparing an acid additional salt of delta-aminolevulinic acid Japan Tobacco Inc. (JP) 1992-05-06 — — EP disclosed
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