Sugi Predict

Sugi Predict / Compounds / SCHEMBL28989

SCHEMBL28989

SCHEMBL28989

O=C(O)c1ccc2c3ccc(C(=O)O)c4cccc(c5cccc1c52)c43

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TYMS P04818 1/20 0.58
▸ NR4A1 P22736 1/20 0.56
▸ NR4A2 P43354 1/20 0.56
▸ NR4A3 Q92570 1/20 0.56
▸ CYP1A2 P05177 3/20 0.52
▸ KDM4E B2RXH2 6/20 0.50
▸ L3MBTL1 Q9Y468 5/20 0.50
▸ ALDH1A1 P00352 4/20 0.50
▸ POLB P06746 4/20 0.50
▸ RECQL P46063 2/20 0.50
▸ CASP6 P55212 2/20 0.50
▸ TDP1 Q9NUW8 2/20 0.50
▸ APOBEC3A P31941 1/20 0.50
▸ APOBEC3G Q9HC16 1/20 0.50
▸ KMT2A Q03164 3/20 0.49
▸ CAMKK1 Q8N5S9 2/20 0.49
▸ CAMKK2 Q96RR4 2/20 0.49
▸ MEN1 O00255 2/20 0.49
▸ MAPT P10636 2/20 0.49
▸ CYP2D6 P10635 2/20 0.49

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
SCHEMBL28007 1.00 TYMS (0.58) TYMSNR4A1NR4A2NR4A3CYP1A2
SCHEMBL29450078 1.00 TYMS (0.58) TYMSNR4A1NR4A2NR4A3CYP1A2
Hydrochloric Acid SCHEMBL8901377 0.98 TYMS (0.56) TYMSNR4A1NR4A2NR4A3CYP1A2
SCHEMBL14052567 0.98 TYMS (0.56) TYMSNR4A1NR4A2NR4A3CYP1A2
SCHEMBL11335171 0.98 TYMS (0.56) TYMSNR4A1NR4A2NR4A3CYP1A2
SCHEMBL2173708 0.94 CYP1A2 (0.58) TYMSNR4A1NR4A2NR4A3CYP1A2
SCHEMBL8601022 0.92 NR4A1 (0.59) TYMSNR4A1NR4A2NR4A3CYP1A2
Formic Acid SCHEMBL28707649 0.87 CYP1A2 (0.50) TYMSNR4A1NR4A2NR4A3CYP1A2
SCHEMBL2830679 0.86 NR4A1 (0.61) TYMSNR4A1NR4A2NR4A3CYP1A2
SCHEMBL31401789 0.86 NR4A1 (0.61) TYMSNR4A1NR4A2NR4A3CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115124854-B Production method of C.I. solvent green 5 and its series derivative and intermediate 鞍山市五色石新材料科技有限公司 2024-04-26 — — CN disclosed
CN-115124854-B Production method of C.I. solvent green 5 and its series derivative and intermediate 鞍山市五色石新材料科技有限公司 2024-04-26 — — CN disclosed
CN-115124854-A Production method of C.I. solvent green 5 and series derivatives and intermediates thereof 鞍山市五色石新材料科技有限公司 2022-09-30 — — CN disclosed
CN-115124854-A Production method of C.I. solvent green 5 and series derivatives and intermediates thereof 鞍山市五色石新材料科技有限公司 2022-09-30 — — CN disclosed
CN-111892605-B Novel five-membered ring perylene diimide molecular material, and preparation method and application thereof 中国科学院化学研究所 2021-11-02 — — CN disclosed
CN-111892605-A Novel five-membered ring perylene diimide molecular material, and preparation method and application thereof 中国科学院化学研究所 2020-11-06 — — CN disclosed
EP-2714842-B1 COLOR CONVERSION FILMS COMPRISING POLYMER-SUBSTITUTED ORGANIC FLUORESCENT DYES ECOLE POLYTECHNIQUE FED LAUSANNE EPFL (CH) 2017-02-22 — — EP disclosed
US-8986842-B2 Color conversion films comprising polymer-substituted organic fluorescent dyes ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) (CH) 2015-03-24 — — US disclosed
CN-103773080-A Solvent green 5 isomer based solvent dye LIANYUNGANG RIWA CHEMICAL CO LTD 2014-05-07 — — CN disclosed
US-8507612-B2 Aziridine crosslinking agents for acrylic adhesives 3M INNOVATIVE PROPERTIES COMPANY (US) 2013-08-13 — — US disclosed
US-20120301724-A1 COLOR CONVERSION FILMS COMPRISING POLYMER-SUBSTITUTED ORGANIC FLUORESCENT DYES ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) (CH) 2012-11-29 — — US disclosed
EP-2406338-B1 AZIRIDINE CROSSLINKING AGENTS FOR ACRYLIC ADHESIVES 3M INNOVATIVE PROPERTIES CO (US) 2012-11-28 — — EP disclosed
EP-2406338-A1 AZIRIDINE CROSSLINKING AGENTS FOR ACRYLIC ADHESIVES 3M Innovative Properties Company (US) 2012-01-18 — — EP disclosed
US-20110149393-A1 Polycyclic Organic Compounds, Polarizing Elements and Method of Production Thereof Crysoptic KK (JP) 2011-06-23 — — US disclosed
WO-2010104645-A1 AZIRIDINE CROSSLINKING AGENTS FOR ACRYLIC ADHESIVES 3M INNOVATIVE PROPERTIES COMPANY (US) 2010-09-16 — — WO disclosed
US-20100227969-A1 AZIRIDINE CROSSLINKING AGENTS FOR ACRYLIC ADHESIVES 3M INNOVATIVE PROPERTIES COMPANY 2010-09-09 — — US disclosed
EP-1019388-B1 PREPARATION OF PERYLENE-3,4-DICARBOXYLIC ANHYDRIDES CIBA SC HOLDING AG (CH) 2007-03-14 — — EP disclosed
EP-1019388-A1 PREPARATION OF PERYLENE-3,4-DICARBOXYLIC ANHYDRIDES Ciba SC Holding AG (CH) 2000-07-19 — — EP disclosed
US-5981773-A REACTING A CORRESPONDING PERYLENE-3,4:9,10-TETRACARBOXYLIC DIANHYDRIDE WITH A STERICALLY HINDERED AMINE, AS A BASE, AT AN ELEVATED TEMPERATURE CIBA SPECIALTY CHEMICALS CORPORATION (US) 1999-11-09 — — US disclosed
WO-1998031678-A1 PREPARATION OF PERYLENE-3,4-DICARBOXYLIC ANHYDRIDES CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 1998-07-23 — — 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 (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-20100227969-A1 AZIRIDINE CROSSLINKING AGENTS FOR ACRYLIC ADHESIVES AAAS, ADGRF1, CDH1 TYMS 4573/4885NR4A1 3781/4885NR4A2 3480/4885
US-20110149393-A1 Polycyclic Organic Compounds, Polarizing Elements and Method of Production Thereof CCNB1, CCNB2, CCNE2 TYMS 182/4885NR4A1 837/4885NR4A2 1455/4885

“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.