SCHEMBL351698

SCHEMBL351698

O[C](O)Cc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 2/20 0.60
CES2 O00748 1/20 0.60
AKR1B1 P15121 1/20 0.60
TSHR P16473 2/20 0.53
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
HDAC8 Q9BY41 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
CALM1 P0DP23 1/20 0.50
FNTA P49354 1/20 0.48
FNTB P49356 1/20 0.48
KEAP1 Q14145 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
ALDH1A1 P00352 3/20 0.46
MAPK1 P28482 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
CTBP2 P56545 1/20 0.46
EPHX2 P34913 1/20 0.46
IDO1 P14902 2/20 0.46
THRB P10828 1/20 0.46

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
SCHEMBL5071007 0.80 CES1 (0.60) CES1CES2AKR1B1TSHRMEN1
SCHEMBL4981463 0.80 CES1 (0.60) CES1CES2AKR1B1TSHRMEN1
SCHEMBL2975898 0.76
Phenylacetic Acid SCHEMBL13618842 0.75 AKR1B1 (1.00) CES1CES2AKR1B1TSHRMEN1
SCHEMBL822099 0.75 CES1 (0.55) CES1CES2AKR1B1TSHRMEN1
SCHEMBL575184 0.75 CES1 (0.55) CES1CES2AKR1B1TSHRMEN1
Phenylacetic Acid SCHEMBL9449909 0.75 AKR1B1 (1.00) CES1CES2AKR1B1TSHRMEN1
SCHEMBL77563 0.75 CES1 (0.70) CES1CES2AKR1B1TSHRMEN1
SCHEMBL57392 0.75 CES1 (0.55) CES1CES2AKR1B1TSHRMEN1
SCHEMBL8993215 0.75 CES1 (0.55) CES1CES2AKR1B1TSHRMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008072850-A1 TRIAZINE DERIVATIVES HAVING INHIBITORY ACTIVITY AGAINST ACETYL-COA CARBOXYLASE AMOREPACIFIC CORPORATION (KR) 2008-06-19 WO claimed
WO-1998019693-A1 COMBINATORIAL LIBRARIES OF CYCLIC UREA AND CYCLIC THIOUREA DERIVATIVES AND COMPOUNDS THEREIN TREGA BIOSCIENCES, INC. (US) 1998-05-14 WO claimed
CN-118325004-A Phenolic hydroxyl group-containing resin, photosensitive resin composition, curable composition, and resist film DIC株式会社 2024-07-12 CN disclosed
CN-118011733-A Positive photosensitive resin composition, resist film, resist underlayer film, and resist permanent film DIC株式会社 2024-05-10 CN disclosed
WO-2024085208-A1 COMPOUND, POLYMERIZABLE COMPOSITION, POLYMER, HOLOGRAM RECORDING MEDIUM, OPTICAL MATERIAL, AND OPTICAL COMPONENT 三菱ケミカル株式会社 2024-04-25 WO disclosed
WO-2024063135-A1 COMPOUND, POLYMERIZABLE COMPOSITION, POLYMER, HOLOGRAM RECORDING MEDIUM, OPTICAL MATERIAL, AND OPTICAL COMPONENT 三菱ケミカル株式会社 2024-03-28 WO disclosed
EP-4317155-A1 COMPOUND, METHOD FOR PRODUCING SAME, POLYMERIZABLE COMPOSITION, POLYMER, HOLOGRAPHIC RECORDING MEDIUM, OPTICAL MATERIAL, AND OPTICAL COMPONENT Mitsubishi Chemical Corporation (JP) 2024-02-07 EP disclosed
CN-117487097-A Surface-modified carbon black, carbon black dispersion, and black resist composition DIC株式会社 2024-02-02 CN disclosed
US-20240018137-A1 COMPOUND, METHOD FOR PRODUCING SAME, POLYMERIZABLE COMPOSITION, POLYMER, HOLOGRAPHIC RECORDING MEDIUM, OPTICAL MATERIAL, AND OPTICAL COMPONENT MITSUBISHI CHEMICAL CORPORATION (JP) 2024-01-18 US disclosed
WO-2024005140-A1 COMPOUND, POLYMERIZABLE COMPOSITION, POLYMER, HOLOGRAPHIC RECORDING MEDIUM, OPTICAL MATERIAL AND OPTICAL COMPONENT 三菱ケミカル株式会社 2024-01-04 WO disclosed
CN-117321109-A Phenolic hydroxyl group-containing resin DIC株式会社 2023-12-29 CN disclosed
EP-2063324-A1 VOLUME HOLOGRAM OPTICAL RECORDING MEDIUM, COMPOSITION FOR FORMING VOLUME HOLOGRAM RECORDING LAYER, VOLUME HOLOGRAM RECORDING MATERIAL, AND VOLUME HOLOGRAM OPTICAL RECORDING METHOD Mitsubishi Chemical Corporation (JP) 2009-05-27 EP disclosed
WO-2008072850-A1 TRIAZINE DERIVATIVES HAVING INHIBITORY ACTIVITY AGAINST ACETYL-COA CARBOXYLASE AMOREPACIFIC CORPORATION (KR) 2008-06-19 WO disclosed
EP-1637568-B1 Ink composition for inkjet recording and inkjet recording method FUJIFILM CORP (JP) 2007-12-26 EP disclosed
EP-1637568-A1 Ink composition for inkjet recording and inkjet recording method FUJI PHOTO FILM CO., LTD. (JP) 2006-03-22 EP disclosed
WO-1998019693-A1 COMBINATORIAL LIBRARIES OF CYCLIC UREA AND CYCLIC THIOUREA DERIVATIVES AND COMPOUNDS THEREIN TREGA BIOSCIENCES, INC. (US) 1998-05-14 WO disclosed
EP-0057777-B1 DIBENZOXAZONINE, DIBENZOXAZECINE, DIBENZOXAAZACYCLOUNDECANE DERIVATIVES AND THEIR CORRESPONDING THIA- AND AZA DERIVATIVES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS AKZO N.V. (NL) 1984-10-10 EP disclosed
US-4374133-A PSYCHOLOGICAL DISORDERS AKZO N.V. (NL) 1983-02-15 US disclosed
EP-0057777-A1 Dibenzoxazonine, dibenzoxazecine, dibenzoxaazacycloundecane derivatives and their corresponding thia- and aza derivatives, their preparation and pharmaceutical compositions AKZO N.V. (NL) 1982-08-18 EP disclosed
WO-1982002199-A1 TRICYCLIC COMPOUNDS AKZO NV (NL) 1982-07-08 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 (1 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-20240018137-A1 COMPOUND, METHOD FOR PRODUCING SAME, POLYMERIZABLE COMPOSITION, POLYMER, HOLOGRAPHIC RECORDING MEDIUM, OPTICAL MATERIAL, AND OPTICAL COMPONENT F12, SEM1, NOX1 CES1 3961/4885CES2 4671/4885AKR1B1 3189/4885

“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.