SCHEMBL8206768

SCHEMBL8206768

C=C(C)COc1ccc(OCCOC(=O)CN2C(=O)c3ccccc3C2=O)cc1

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.60
▸ POLB P06746 2/20 0.57
▸ APEX1 P27695 1/20 0.57
▸ HSD17B10 Q99714 1/20 0.57
▸ TDP1 Q9NUW8 1/20 0.57
▸ NPSR1 Q6W5P4 2/20 0.52
▸ RXFP1 Q9HBX9 1/20 0.49
▸ LMNA P02545 1/20 0.49
▸ PKM P14618 1/20 0.49
▸ HPGD P15428 1/20 0.48
▸ L3MBTL1 Q9Y468 2/20 0.47
▸ RAB9A P51151 1/20 0.47

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
SCHEMBL7696703 0.79 ALDH1A1 (0.57) ALDH1A1POLBAPEX1HSD17B10TDP1
SCHEMBL8218171 0.79 ALDH1A1 (0.57) ALDH1A1POLBAPEX1HSD17B10TDP1
SCHEMBL8210374 0.77 TDP1 (0.47) ALDH1A1POLBAPEX1HSD17B10TDP1
SCHEMBL521967 0.76 ALDH1A1 (0.83) ALDH1A1POLBNPSR1RXFP1LMNA
SCHEMBL7778728 0.76 ALDH1A1 (0.54) ALDH1A1POLBAPEX1HSD17B10TDP1
SCHEMBL31050182 0.75 KMT2A (0.64) ALDH1A1POLBRAB9A
SCHEMBL29000793 0.73 ALDH1A1 (0.72) ALDH1A1TDP1NPSR1LMNAPKM
SCHEMBL12297895 0.72 HSD17B10 (1.00) POLBAPEX1HSD17B10TDP1NPSR1
SCHEMBL11453331 0.72 ALDH1A1 (0.77) ALDH1A1HSD17B10NPSR1L3MBTL1
SCHEMBL24370563 0.72 NPSR1 (0.74) ALDH1A1POLBTDP1NPSR1LMNA

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
EP-0799246-B1 IMPROVED MUTABLE COMPOSITION KIMBERLY CLARK CO (US) 2000-11-15 — — EP disclosed
EP-1020478-A1 Method of making a substrate comprising a colored composition by using an improved mutable composition and so produced substrate Kimberly-Clark Worldwide, Inc. (US) 2000-07-19 — — EP disclosed
EP-0799246-A1 IMPROVED MUTABLE COMPOSITION Kimberly-Clark Worldwide, Inc. (US) 1997-10-08 — — EP disclosed
WO-1996019502-A1 IMPROVED MUTABLE COMPOSITION KIMBERLY-CLARK WORLDWIDE, INC. (US) 1996-06-27 — — WO disclosed
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