SCHEMBL382102

SCHEMBL382102

CCOC(=O)c1ccc(-c2ccc(OCCOC(C)=O)c(Br)c2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 1/20 0.44
PDGFRA P16234 1/20 0.44
HPGD P15428 1/20 0.44
HTT P42858 1/20 0.44
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
CA12 O43570 2/20 0.42
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
CA7 P43166 2/20 0.42
CA9 Q16790 2/20 0.42
CA14 Q9ULX7 2/20 0.42
ESR1 P03372 1/20 0.42
ESR2 Q92731 1/20 0.42
PTPN11 Q06124 1/20 0.42
KCNH2 Q12809 1/20 0.41
HRH3 Q9Y5N1 1/20 0.41
LMNA P02545 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41

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
SCHEMBL27158932 0.94 PTPN11 (0.44) PDGFRBPDGFRAHPGDHTTTDP1
SCHEMBL27158845 0.94 PTPN11 (0.46) PDGFRBPDGFRAHPGDHTTTDP1
SCHEMBL27686777 0.86 PTPN11 (0.53) PTPN11
SCHEMBL25747854 0.86 TDP1 (0.47) HPGDHTTTDP1L3MBTL1LMNA
SCHEMBL31347273 0.85 PDGFRB (0.44) PDGFRBPDGFRAHPGDHTTTDP1
SCHEMBL25747758 0.85 PDE4A (0.50) PTPN11
SCHEMBL13276868 0.83 ESR1 (0.49) TDP1L3MBTL1ESR1KCNH2HRH3
SCHEMBL25747761 0.79 MMP3 (0.44) HRH3MAPT
SCHEMBL381628 0.79 PDGFRB (0.41) PDGFRBPDGFRAHPGDHTTTDP1
SCHEMBL383677 0.79 PTPN11 (0.42) PDGFRBPDGFRAHPGDHTTCA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115594647-A New preparation method of Qu Faluo heater 北京万全德众医药生物技术有限公司(CN) 2023-01-13 CN claimed
US-20240217992-A1 RETINOIC ACID RECEPTOR AGONIST, PREPARATION METHOD THEREFOR, INTERMEDIATE, PHARMACEUTICAL COMPOSITION AND USE Jiangxi Kerui Pharmaceutical Co., Ltd. (CN) 2024-07-04 US disclosed
US-20240217992-A1 RETINOIC ACID RECEPTOR AGONIST, PREPARATION METHOD THEREFOR, INTERMEDIATE, PHARMACEUTICAL COMPOSITION AND USE Jiangxi Kerui Pharmaceutical Co., Ltd. (CN) 2024-07-04 US disclosed
US-20240217992-A1 RETINOIC ACID RECEPTOR AGONIST, PREPARATION METHOD THEREFOR, INTERMEDIATE, PHARMACEUTICAL COMPOSITION AND USE Jiangxi Kerui Pharmaceutical Co., Ltd. (CN) 2024-07-04 US disclosed
EP-4332108-A1 RETINOIC ACID RECEPTOR AGONIST, PREPARATION METHOD THEREFOR, INTERMEDIATE, PHARMACEUTICAL COMPOSITION AND USE Jiangxi Kerui Pharmaceutical Co., Ltd. (CN) 2024-03-06 EP disclosed
CN-115594647-A New preparation method of Qu Faluo heater 北京万全德众医药生物技术有限公司(CN) 2023-01-13 CN disclosed
CN-115594647-A New preparation method of Qu Faluo heater 北京万全德众医药生物技术有限公司(CN) 2023-01-13 CN disclosed
WO-2022228409-A1 RETINOIC ACID RECEPTOR AGONIST, PREPARATION METHOD THEREFOR, INTERMEDIATE, PHARMACEUTICAL COMPOSITION AND USE 上海旭成医药科技有限公司 2022-11-03 WO disclosed
CN-115246856-A Retinoic acid receptor agonist, preparation method, intermediate, pharmaceutical composition and application thereof 上海旭成医药科技有限公司 2022-10-28 CN disclosed
US-8470871-B2 Ligands that modulate RAR receptors GALDERMA RESEARCH & DEVELOPMENT (FR) 2013-06-25 US disclosed
US-20120258996-A1 NOVEL LIGANDS THAT MODULATE RAR RECEPTORS GALDERMA RESEARCH & DEVELOPMENT (FR) 2012-10-11 US disclosed
US-8227507-B2 Ligands that modulate RAR receptors GALDERMA RESEARCH & DEVELOPMENT (FR) 2012-07-24 US disclosed
EP-1831149-B1 NOVEL LIGANDS THAT MODULATE RAR RECEPTORS AND USE THEREOF IN HUMAN MEDICINE AND IN COSMETICS GALDERMA RES & DEV (FR) 2012-01-25 EP disclosed
US-20100292296-A1 NOVEL LIGANDS THAT MODULATE RAR RECEPTORS GALDERMA RESEARCH & DEVELOPMENT (FR) 2010-11-18 US disclosed
US-7807708-B2 Ligands that modulate RAR receptors and pharmaceutical/cosmetic compositions comprised thereof GALDERMA RESEARCH & DEVELOPMENT (FR) 2010-10-05 US disclosed
US-20080015246-A1 Novel ligands that modulate RAR receptors and pharmaceutical/cosmetic compositions comprised thereof GALDERMA RESEARCH & DEVELOPMENT (FR) 2008-01-17 US disclosed
EP-1831149-A1 NOVEL LIGANDS THAT MODULATE RAR RECEPTORS AND USE THEREOF IN HUMAN MEDICINE AND IN COSMETICS GALDERMA RESEARCH & DEVELOPMENT (FR) 2007-09-12 EP disclosed
WO-2006066978-A1 NOVEL LIGANDS THAT MODULATE RAR RECEPTORS, AND USE THEREOF IN HUMAN MEDICINE AND IN COSMETICS GALDERMA RESEARCH & DEVELOPMENT (FR) 2006-06-29 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20240217992-A1 RETINOIC ACID RECEPTOR AGONIST, PREPARATION METHOD THEREFOR, INTERMEDIATE, PHARMACEUTICAL COMPOSITION AND USE RARA, RARG, RXRG PDGFRB 1682/4885PDGFRA 967/4885HPGD 901/4885
US-20080015246-A1 Novel ligands that modulate RAR receptors and pharmaceutical/cosmetic compositions comprised thereof RARB, RARA, RARG PDGFRB 613/4885PDGFRA 459/4885HPGD 1228/4885
US-20120258996-A1 NOVEL LIGANDS THAT MODULATE RAR RECEPTORS RARB, RARA, RARG PDGFRB 630/4885PDGFRA 454/4885HPGD 1796/4885
US-20100292296-A1 NOVEL LIGANDS THAT MODULATE RAR RECEPTORS RARB, RARA, RARG PDGFRB 630/4885PDGFRA 454/4885HPGD 1796/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.