SCHEMBL5710069

SCHEMBL5710069

CCCCCCc1ccc(C(=O)c2ccc(O)cc2O)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 1/20 0.59
ALDH1A1 P00352 3/20 0.57
TP53 P04637 3/20 0.57
ESR1 P03372 2/20 0.57
ADRA2A P08913 2/20 0.57
ADORA3 P0DMS8 2/20 0.57
TACR2 P21452 2/20 0.57
SLC6A2 P23975 2/20 0.57
SLC6A4 P31645 2/20 0.57
SLC6A3 Q01959 2/20 0.57
KDM4E B2RXH2 2/20 0.57
CYP3A4 P08684 2/20 0.57
LMNA P02545 1/20 0.57
SHBG P04278 1/20 0.57
HSPD1 P10809 1/20 0.57
ADRB3 P13945 1/20 0.57
HTR2C P28335 1/20 0.57
HSPE1 P61604 1/20 0.57
HIF1A Q16665 1/20 0.57
TST Q16762 1/20 0.57

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
SCHEMBL5710056 1.00 PPARA (0.59) PPARAALDH1A1TP53ESR1ADRA2A
SCHEMBL30375203 1.00 PPARA (0.59) PPARAALDH1A1TP53ESR1ADRA2A
SCHEMBL30320336 1.00 PPARA (0.59) PPARAALDH1A1TP53ESR1ADRA2A
SCHEMBL30374810 1.00 PPARA (0.59) PPARAALDH1A1TP53ESR1ADRA2A
SCHEMBL5709907 1.00 PPARA (0.59) PPARAALDH1A1TP53ESR1ADRA2A
SCHEMBL30375029 1.00 PPARA (0.59) PPARAALDH1A1TP53ESR1ADRA2A
SCHEMBL5709909 1.00 PPARA (0.59) PPARAALDH1A1TP53ESR1ADRA2A
SCHEMBL30374859 0.99 PPARA (0.57) PPARAALDH1A1TP53ESR1ADRA2A
SCHEMBL5710176 0.99 PPARA (0.57) PPARAALDH1A1TP53ESR1ADRA2A
SCHEMBL5710052 0.94 MEN1 (0.56) PPARAALDH1A1TP53ESR1ADRA2A

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 13 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-116209725-A Reversible thermochromic composition and reversible thermochromic microcapsule pigment having the same encapsulated therein 百乐墨水株式会社 2023-06-02 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-116113548-A Reversible thermochromic composition and reversible thermochromic microcapsule pigment containing same 百乐墨水株式会社 2023-05-12 CN disclosed
WO-2022065230-A1 REVERSIBLE THERMOCHROMIC COMPOSITION AND REVERSIBLE THERMOCHROMIC MICROCAPSULE PIGMENT ENCAPSULATING SAME パイロットインキ株式会社 2022-03-31 WO disclosed
WO-2022065228-A1 REVERSIBLE THERMOCHROMIC COMPOSITION AND REVERSIBLE THERMOCHROMIC MICROCAPSULE PIGMENT ENCAPSULATING SAME パイロットインキ株式会社 2022-03-31 WO disclosed
WO-2022065229-A1 REVERSIBLE THERMOCHROMIC COMPOSITION AND REVERSIBLE THERMOCHROMIC MICROCAPSULE PIGMENT ENCAPSULATING SAME パイロットインキ株式会社 2022-03-31 WO 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