SCHEMBL83331

SCHEMBL83331

O=C(COC(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.79
NPC1 O15118 7/20 0.79
HPGD P15428 2/20 0.79
L3MBTL1 Q9Y468 2/20 0.79
ESR1 P03372 1/20 0.69
ESR2 Q92731 1/20 0.69
SMN1; SMN2 Q16637 3/20 0.64
MAPT P10636 2/20 0.64
ALOX5 P09917 1/20 0.64
ALDH1A1 P00352 3/20 0.64
GAA P10253 2/20 0.64
NFKB1 P19838 1/20 0.64
NFKB2 Q00653 1/20 0.64
RELA Q04206 1/20 0.64
LMNA P02545 1/20 0.64
TDP1 Q9NUW8 2/20 0.61
KDM4E B2RXH2 2/20 0.59
MAPK1 P28482 1/20 0.59
HIF1A Q16665 1/20 0.59
SLC6A2 P23975 1/20 0.59

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
SCHEMBL29043248 0.98 RAB9A (0.77) RAB9ANPC1HPGDL3MBTL1ESR1
SCHEMBL22319774 0.89 RAB9A (0.71) RAB9ANPC1HPGDL3MBTL1ESR1
SCHEMBL16398364 0.89 RAB9A (1.00) RAB9ANPC1HPGDL3MBTL1ESR1
SCHEMBL11273679 0.89 RAB9A (1.00) RAB9ANPC1HPGDL3MBTL1ESR1
SCHEMBL27832225 0.89 RAB9A (0.71) RAB9ANPC1HPGDL3MBTL1ESR1
SCHEMBL16398834 0.89 RAB9A (0.71) RAB9ANPC1HPGDL3MBTL1ESR1
SCHEMBL5454957 0.88 RAB9A (0.69) RAB9ANPC1HPGDL3MBTL1ESR1
SCHEMBL11686421 0.86 RAB9A (0.67) RAB9ANPC1HPGDL3MBTL1ESR1
SCHEMBL6777691 0.86 RAB9A (0.71) RAB9ANPC1HPGDL3MBTL1ESR1
SCHEMBL11759747 0.86 ESR2 (0.77) RAB9ANPC1HPGDL3MBTL1ESR1

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 179 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105676543-B Method for manufacturing liquid crystal display device 乐金显示有限公司 2021-02-02 CN claimed
US-9834570-B2 One step process for regioselective synthesis of α-acyloxy carbonyls COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2017-12-05 US claimed
US-20160115182-A1 ONE STEP PROCESS FOR REGIOSELECTIVE SYNTHESIS OF ALPHA-ACYLOXY CARBONYLS COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2016-04-28 US claimed
WO-2014195972-A1 ONE STEP PROCESS FOR REGIOSELECTIVE SYNTHESIS OF α-ACYLOXY CARBONYLS COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2014-12-11 WO claimed
EP-0445628-B1 Polymerizable nematic monomer compositions HERCULES INC (US) 1995-01-25 EP claimed
EP-0445629-B1 Process of preparing liquid crystal compositions containing multiple oriented mesogens HERCULES INC (US) 1994-09-21 EP claimed
US-5202053-A Blends HERCULES INCORPORATED (US) 1993-04-13 US claimed
US-5073294-A Liquid crystal polymers HERCULES INCORPORATED (US) 1991-12-17 US claimed
EP-0445629-A2 Process of preparing liquid crystal compositions containing multiple oriented mesogens HERCULES INCORPORATED (US) 1991-09-11 EP claimed
EP-0445628-A2 Polymerizable nematic monomer compositions HERCULES INCORPORATED (US) 1991-09-11 EP claimed
US-20260022036-A1 PERVAPORATION MEMBRANE NITTO DENKO CORP (JP) 2026-01-22 US disclosed
EP-4596090-A1 PERVAPORATION MEMBRANE NITTO DENKO CORPORATION (JP) 2025-08-06 EP disclosed
WO-2024071840-A1 INFRARED RAY-TRANSMITTING PHOTOSENSITIVE RESIN COMPOSITION 동우 화인켐 주식회사 2024-04-04 WO disclosed
CN-109803960-B Compound, photosensitive resin composition containing the same and color filter 三星SDI株式会社 2023-04-11 CN disclosed
CN-109715599-B Novel compound, core-shell dye, photosensitive resin composition containing the same, and color filter 三星SDI株式会社 2023-02-28 CN disclosed
US-5202053-A Blends HERCULES INCORPORATED (US) 1993-04-13 US disclosed
US-5073294-A Liquid crystal polymers HERCULES INCORPORATED (US) 1991-12-17 US disclosed
EP-0445629-A2 Process of preparing liquid crystal compositions containing multiple oriented mesogens HERCULES INCORPORATED (US) 1991-09-11 EP disclosed
EP-0445628-A2 Polymerizable nematic monomer compositions HERCULES INCORPORATED (US) 1991-09-11 EP disclosed
US-4637896-A CHOLESTERIC, PHOTOPOLYMERIZATION, PHOTOINITIATORS, (METH) ACRYLATE DERIVATIVES OF (DIHYDRO)CHOLESTEROL ARMSTRONG WORLD INDUSTRIES, INC. (US) 1987-01-20 US 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 (2 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-20260022036-A1 PERVAPORATION MEMBRANE SLC2A4, VDAC1, VMA21 RAB9A 3883/4885NPC1 279/4885HPGD 2783/4885
US-20160115182-A1 ONE STEP PROCESS FOR REGIOSELECTIVE SYNTHESIS OF ALPHA-ACYLOXY CARBONYLS ACACB, ACACA, COASY RAB9A 2287/4885NPC1 327/4885HPGD 296/4885

“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.