Sugi Predict

Sugi Predict / Compounds / SCHEMBL128399

SCHEMBL128399

SCHEMBL128399

CCOc1[c]c(OCC)ccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NQO1 P15559 1/20 0.43
▸ TP53 P04637 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.38
▸ LTA4H P09960 1/20 0.38
▸ TDP1 Q9NUW8 2/20 0.36
▸ TSHR P16473 1/20 0.36
▸ L3MBTL1 Q9Y468 3/20 0.35
▸ RELA Q04206 1/20 0.34
▸ RXRA P19793 1/20 0.34
▸ RXRB P28702 1/20 0.34
▸ MAPT P10636 2/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ GLA P06280 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ PABPC1 P11940 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ CYP2A6 P11509 1/20 0.32

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
SCHEMBL743598 0.91 SMN1; SMN2 (0.38) NQO1TP53CYP3A4ALDH1A1LTA4H
SCHEMBL2962480 0.86 NQO1 (0.37) NQO1TP53CYP3A4ALDH1A1LTA4H
SCHEMBL28912045 0.84 NQO1 (0.36) NQO1TP53CYP3A4ALDH1A1LTA4H
SCHEMBL159421 0.84 NQO1 (0.36) NQO1TP53CYP3A4ALDH1A1LTA4H
SCHEMBL7227995 0.84 TSHR (0.43) NQO1TP53CYP3A4ALDH1A1LTA4H
SCHEMBL15352909 0.84 NQO1 (0.36) NQO1TP53CYP3A4ALDH1A1LTA4H
SCHEMBL7768476 0.84 NQO1 (0.36) NQO1TP53CYP3A4ALDH1A1LTA4H
SCHEMBL7772526 0.84 NQO1 (0.36) NQO1TP53CYP3A4ALDH1A1LTA4H
SCHEMBL3523639 0.84 L3MBTL1 (0.38) NQO1TP53CYP3A4ALDH1A1LTA4H
SCHEMBL15353224 0.84 L3MBTL1 (0.36) NQO1TP53CYP3A4L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11926746-B2 Active energy ray-curable ink and image recording method FUJIFILM CORPORATION (JP) 2024-03-12 — — US claimed
CN-114728520-B Active energy ray-curable ink and image recording method 富士胶片株式会社 2024-03-08 — — CN claimed
CN-114797989-B Supported catalyst and preparation method and application thereof 卫星化学股份有限公司 2024-02-23 — — CN claimed
CN-117164641-A Nickel complex for synthesizing polyketone resin, preparation method and application 大连理工大学 2023-12-05 — — CN claimed
CN-116969996-A Ethylene selective trimerization catalytic ligand, preparation method, catalytic system and application thereof 卫星化学股份有限公司 2023-10-31 — — CN claimed
CN-116621875-A Novel phosphine center chiral ligand and synthesis method and application thereof 大连理工大学 2023-08-22 — — CN claimed
CN-116178267-A Chiral N-heterocyclic carbene nitrile oxide adduct organic catalyst and application thereof 大连理工大学 2023-05-30 — — CN claimed
US-11555081-B2 Multifunctional bisacylphosphine oxide photoinitiators IGM RESINS ITALIA S.R.L. (IT) 2023-01-17 — — US claimed
CN-114573804-B Polyketone polymer and preparation method thereof 大连理工大学 2023-01-03 — — CN claimed
EP-4059719-A1 ACTIVE ENERGY BEAM-CURABLE INK AND IMAGE RECORDING METHOD FUJIFILM Corporation (JP) 2022-09-21 — — EP claimed
US-20090053192-A1 TISSUE-NONSPECIFIC ALKALINE PHOSPHATASE (TNAP) ACTIVATORS AND USES THEREOF BURNHAM INSTITUTE FOR MEDICAL RESEARCH (US) 2009-02-26 — — US claimed
US-20090044863-A1 CORONENE CHARGE-TRANSPORT MATERIALS, METHODS OF FABRICATION THEREOF, AND METHODS OF USE THEREOF NATIONAL SCIENCE FOUNDATION 2009-02-19 — — US claimed
US-20080223444-A1 Perylene Charge-Transport Materials, Methods of Fabrication Thereof, and Methods of Use Thereof GEORGIA TECH RESEARCH CORPORATION 2008-09-18 — — US claimed
US-7368604-B2 Method for the production of acylphosphine oxides BASF AKTIENGESELLSCHAFT (DE) 2008-05-06 — — US claimed
WO-2006093965-A2 CORONENE CHARGE-TRANSPORT MATERIALS, METHODS OF FABRICATION THEREOF, AND METHODS OF USE THEREOF GEORGIA TECH RESEARCH CORPORATION (US) 2006-09-08 — — WO claimed
EP-1546163-B1 METHOD FOR THE PRODUCTION OF ACYLPHOSPHINE OXIDES BASF AG (DE) 2006-07-12 — — EP claimed
WO-2005124453-A2 PERYLENE CHARGE-TRANSPORT MATERIALS, METHODS OF FABRICATION THEREOF, AND METHODS OF USE THEREOF GEORGIA TECH RESEARCH CORPORATION (US) 2005-12-29 — — WO claimed
US-6300368-B1 FOR THERAPY OF ATRIAL ARRHYTHMIA MITSUI CHEMICALS, INC. (JP) 2001-10-09 — — US claimed
EP-0968999-A1 Anilide derivatives and antiarrhythmic agents containing the same Mitsui Chemicals, Inc. (JP) 2000-01-05 — — EP claimed
US-5210311-A Aromatic tetradentate phosphine SHELL OIL COMPANY (US) 1993-05-11 — — US claimed

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-11555081-B2 Multifunctional bisacylphosphine oxide photoinitiators PHOSPHO1, AGPAT5, PARG NQO1 382/4885TP53 1645/4885CYP3A4 1345/4885
US-20080223444-A1 Perylene Charge-Transport Materials, Methods of Fabrication Thereof, and Methods of Use Thereof SLC43A1, SLC3A2, SLC16A3 NQO1 1178/4885TP53 2921/4885CYP3A4 2291/4885
US-20090044863-A1 CORONENE CHARGE-TRANSPORT MATERIALS, METHODS OF FABRICATION THEREOF, AND METHODS OF USE THEREOF SLC18A3, CORO1C, SLC18A1 NQO1 642/4885TP53 1745/4885CYP3A4 3058/4885
US-20090053192-A1 TISSUE-NONSPECIFIC ALKALINE PHOSPHATASE (TNAP) ACTIVATORS AND USES THEREOF ALPL, ALPP, ACP3 NQO1 2598/4885TP53 3052/4885CYP3A4 4763/4885

“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.