Sugi Predict

Sugi Predict / Compounds / SCHEMBL668261

SCHEMBL668261

SCHEMBL668261

CCCCOc1cc[c]c2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CYP2C9 P11712 2/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46
▸ HTR1B P28222 5/20 0.43
▸ GAA P10253 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ CNR1 P21554 3/20 0.43
▸ CNR2 P34972 3/20 0.43
▸ HTR1D P28221 2/20 0.41
▸ SLC2A1 P11166 1/20 0.40
▸ LTA4H P09960 2/20 0.40
▸ KCNH2 Q12809 1/20 0.39
▸ MEN1 O00255 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ TLR8 Q9NR97 1/20 0.38
▸ SLC6A4 P31645 1/20 0.37
▸ HRH1 P35367 1/20 0.37

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
SCHEMBL250334 0.95 CNR1 (0.44) CYP2C9CYP1A2CYP2C19HTR1BGAA
SCHEMBL6725624 0.94 MEN1 (0.45) CYP2C9CYP1A2CYP2C19HTR1BGAA
SCHEMBL668349 0.92 CNR1 (0.41) CYP2C9CYP1A2CYP2C19HTR1BCNR1
SCHEMBL2254327 0.89 HTR1B (0.46) CYP2C9CYP1A2CYP2C19HTR1BGAA
SCHEMBL40509 0.84 ALDH1A1 (0.41) CYP1A2CYP2C19GAATDP1L3MBTL1
SCHEMBL9164753 0.84 NCF1 (0.46) CYP1A2CYP2C19HTR1BTDP1L3MBTL1
SCHEMBL15206293 0.83 KDM1A (0.36) HTR1BHTR1DSLC6A4HRH1
SCHEMBL248878 0.83 CNR2 (0.46) HTR1BTDP1CNR1CNR2HTR1D
SCHEMBL11476266 0.83 CNR1 (0.44) CYP2C9CYP1A2CYP2C19HTR1BCNR1
SCHEMBL2253900 0.81 CNR1 (0.45) CYP2C9CYP1A2CYP2C19HTR1BGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111808045-B Method for synthesizing chiral seven-element cyclic sulfonamide through organic catalysis 中国科学院大连化学物理研究所 2022-07-08 — — CN claimed
EP-1225480-B1 Radiation-sensitive resin composition JSR CORP (JP) 2010-03-17 — — EP claimed
US-6838225-B2 Radiation-sensitive resin composition JSR CORPORATION (JP) 2005-01-04 — — US claimed
US-20020132181-A1 Radiation-sensitive resin composition JSR CORPORATION (JP) 2002-09-19 — — US claimed
EP-1225480-A2 Radiation-sensitive resin composition JSR Corporation (JP) 2002-07-24 — — EP claimed
WO-2023157801-A1 PHOTOSENSITIVE RESIN COMPOSITION, METHOD FOR PRODUCING RESIST PATTERN FILM, AND METHOD FOR PRODUCING PLATED SHAPED ARTICLE JSR株式会社 2023-08-24 — — WO disclosed
US-11681222-B2 Fluorine-containing polymer, purification method, and radiation-sensitive resin composition JSR CORPORATION (JP) 2023-06-20 — — US disclosed
US-11678571-B2 Organic electroluminescent device using aryl amine derivative containing heterocycle IDEMITSU KOSAN CO., LTD. (JP) 2023-06-13 — — US disclosed
CN-110473989-B Method for manufacturing organic light emitting element 株式会社LG化学 2022-05-27 — — CN disclosed
US-20220137508-A9 FLUORINE-CONTAINING POLYMER, PURIFICATION METHOD, AND RADIATION-SENSITIVE RESIN COMPOSITION JSR CORPORATION (JP) 2022-05-05 — — US disclosed
US-20210376247-A1 ORGANIC ELECTROLUMINESCENT DEVICE USING ARYL AMINE DERIVATIVE CONTAINING HETEROCYCLE IDEMITSU KOSAN CO., LTD. (JP) 2021-12-02 — — US disclosed
US-11152574-B2 Organic electroluminescent device using aryl amine derivative containing heterocycle IDEMITSU KOSAN CO., LTD. (JP) 2021-10-19 — — US disclosed
US-5391806-A A storage stable chromogens as color-developing agent or stabilizers MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1995-02-21 — — US disclosed
US-5306688-A Color-forming, electron donating compound and electron accepting compound; storage stability of uncolored portion MITSUI TOATSU CHEMICALS, INC. (JP) 1994-04-26 — — US disclosed
US-5270281-A Chromogenic compound MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1993-12-14 — — US disclosed
EP-0534257-A1 Salicylic acid derivatives, the process for preparing the same and the heat-sensitive recording materials comprising thereof MITSUI TOATSU CHEMICALS, Inc. (JP) 1993-03-31 — — EP disclosed
EP-0524419-A1 Heat-sensitive recording materials and phenol compounds MITSUI TOATSU CHEMICALS, Inc. (JP) 1993-01-27 — — EP disclosed
US-4906551-A Process for the post-treatment of developed relief printing forms for use in flexographic printing HOECHST AKTIENGESELLSCHAFT (DE) 1990-03-06 — — US disclosed
EP-0320742-A2 Process for the after-treatment of developed flexographic printing platens E.I. DU PONT DE NEMOURS AND COMPANY (US) 1989-06-21 — — EP disclosed
US-4139537-A 3-Aryloxy-1-(2- or 4-iminodihydro-1-pyridyl)-2-propanol antiarrhythmic compounds COOPER LABORATORIES, INC. (US) 1979-02-13 — — 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 (3 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-11152574-B2 Organic electroluminescent device using aryl amine derivative containing heterocycle RPL21, RPS21, AOC2 CYP2C9 228/4885CYP1A2 170/4885CYP2C19 34/4885
US-11678571-B2 Organic electroluminescent device using aryl amine derivative containing heterocycle RPS17, RPS19, CDK17 CYP2C9 294/4885CYP1A2 1066/4885CYP2C19 93/4885
US-20210376247-A1 ORGANIC ELECTROLUMINESCENT DEVICE USING ARYL AMINE DERIVATIVE CONTAINING HETEROCYCLE RPS17, RPS19, CDK17 CYP2C9 294/4885CYP1A2 1066/4885CYP2C19 93/4885

“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.