SCHEMBL5709902

SCHEMBL5709902

CCc1ccc(C(=O)c2ccc(O)cc2O)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.62
KMT2A Q03164 3/20 0.62
ALDH1A1 P00352 3/20 0.62
MAPT P10636 2/20 0.62
NPC1 O15118 1/20 0.62
TP53 P04637 1/20 0.62
HPGD P15428 1/20 0.62
SMN1; SMN2 Q16637 1/20 0.62
USP2 O75604 1/20 0.62
GAA P10253 1/20 0.62
KEAP1 Q14145 1/20 0.62
NFE2L2 Q16236 1/20 0.62
HSP90AB1 P08238 1/20 0.54
CA12 O43570 3/20 0.54
CA1 P00915 3/20 0.54
CA2 P00918 3/20 0.54
CA7 P43166 3/20 0.54
CA9 Q16790 3/20 0.54
CA14 Q9ULX7 3/20 0.54
ESR1 P03372 1/20 0.51

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
SCHEMBL30375217 1.00 MEN1 (0.62) MEN1KMT2AALDH1A1MAPTNPC1
SCHEMBL30320276 0.87 KMT2A (0.59) MEN1KMT2AALDH1A1MAPTNPC1
SCHEMBL5709868 0.87 KMT2A (0.59) MEN1KMT2AALDH1A1MAPTNPC1
SCHEMBL4654470 0.86 HSP90AB1 (0.58) MEN1KMT2AALDH1A1MAPTNPC1
SCHEMBL10735111 0.86 MEN1 (0.81) MEN1KMT2AALDH1A1MAPTNPC1
SCHEMBL29633666 0.84 HPGD (0.68) MEN1KMT2AALDH1A1MAPTNPC1
SCHEMBL2486574 0.84 HPGD (0.68) MEN1KMT2AALDH1A1MAPTNPC1
SCHEMBL5710052 0.84 MEN1 (0.56) MEN1KMT2AALDH1A1MAPTNPC1
SCHEMBL30320281 0.84 MEN1 (0.56) MEN1KMT2AALDH1A1MAPTNPC1
SCHEMBL13193972 0.84 MEN1 (0.54) MEN1KMT2AALDH1A1MAPTNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113646052-B Reversible thermochromic composition, reversible thermochromic microcapsule pigment, and writing instrument 百乐墨水株式会社 2024-05-17 CN disclosed
CN-113785023-B Water-based ink composition for reversible thermochromic writing instrument, refill for refill and water-based ballpoint pen incorporating same 株式会社百乐 2023-05-12 CN disclosed
CN-113646052-A Reversible thermal discoloration composition, reversible thermal discoloration microcapsule pigment encapsulating the reversible thermal discoloration composition, and writing instrument using the reversible thermal discoloration microcapsule pigment 百乐墨水株式会社 2021-11-12 CN disclosed
WO-2020209118-A1 REVERSIBLY THERMOCHROMIC AQUEOUS INK COMPOSITION FOR WRITING UTENSILS, AND REFILL AND WATER-BASED BALLPOINT PEN EACH INTERNALLY CONTAINING SAME 株式会社パイロットコーポレーション 2020-10-15 WO disclosed
WO-2020203603-A1 REVERSIBLE THERMOCHROMIC COMPOSITION, REVERSIBLE THERMOCHROMIC MICROCAPSULE PIGMENT COMPRISING SAME, AND WRITING INSTRUMENT USING SAME パイロットインキ株式会社 2020-10-08 WO disclosed
EP-1179435-B1 Reversible thermochromic composition having improved light-fastness and product comprising same PILOT INK CO LTD (JP) 2006-11-29 EP disclosed
US-6638620-B2 Discoloration sensitivity THE PILOT INK CO., LTD. (JP) 2003-10-28 US disclosed
EP-1179435-A1 Reversible thermochromic composition having improved light-fastness and product comprising same The Pilot Ink Co., Ltd. (JP) 2002-02-13 EP disclosed