SCHEMBL2044016

SCHEMBL2044016

c1ccc2c(c1)[nH]c1c2ccc2ncoc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 5/20 0.46
▸ TDO2 P48775 5/20 0.45
▸ GABRP O00591 2/20 0.45
▸ GABRD O14764 2/20 0.45
▸ GABRA1 P14867 2/20 0.45
▸ GABRB1 P18505 2/20 0.45
▸ GABRG2 P18507 2/20 0.45
▸ GABRB3 P28472 2/20 0.45
▸ GABRA5 P31644 2/20 0.45
▸ GABRA3 P34903 2/20 0.45
▸ GABRA2 P47869 2/20 0.45
▸ GABRB2 P47870 2/20 0.45
▸ GABRA4 P48169 2/20 0.45
▸ GABRE P78334 2/20 0.45
▸ GABRA6 Q16445 2/20 0.45
▸ GABRG1 Q8N1C3 2/20 0.45
▸ GABRG3 Q99928 2/20 0.45
▸ GABRQ Q9UN88 2/20 0.45
▸ ALDH1A1 P00352 2/20 0.45
▸ HSD17B10 Q99714 2/20 0.45

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
SCHEMBL29113109 0.81 KIF11 (0.47) KIF11ALDH1A1HSD17B10KDM4EMEN1
SCHEMBL31540286 0.81 KIF11 (0.47) KIF11ALDH1A1HSD17B10KDM4EMEN1
SCHEMBL150761 0.77 KIF11 (0.46) KIF11TDO2GABRPGABRDGABRA1
SCHEMBL29010434 0.76 GABRA1 (0.47) KIF11TDO2GABRPGABRDGABRA1
SCHEMBL30636673 0.74 KIF11 (0.46) KIF11TDO2GABRPGABRDGABRA1
SCHEMBL15430845 0.74 KIF11 (0.46) KIF11TDO2GABRPGABRDGABRA1
SCHEMBL191347 0.72 KIF11 (0.71) KIF11TDO2GABRPGABRDGABRA1
SCHEMBL13563976 0.72 KIF11 (0.78) KIF11TDO2GABRPGABRDGABRA1
SCHEMBL29378455 0.72 KIF11 (0.71) KIF11TDO2GABRPGABRDGABRA1
Carbazole SCHEMBL546743 0.71 ALDH1A1 (0.50) KIF11TDO2GABRPGABRDGABRA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115989214-B Pigment composition, inkjet recording method, image recorded matter, and pigment compound 富士胶片株式会社 2025-02-25 — — CN claimed
US-20230173071-A1 TREATMENT OF MYOPIA AND OTHER OCULAR CONDITIONS USING SINGLET OXYGEN GENERATED FROM DYES ACTIVATED BY NEAR-INFRARED LIGHT CALIFORNIA INST OF TECHN (US) 2023-06-08 — — US claimed
US-20200131370-A1 Near-Infrared Heptamethine Dyes For Generation Of Singlet Oxygen CALIFORNIA INSTITUTE OF TECHNOLOGY 2020-04-30 — — US claimed
US-20200129620-A1 Treatment Of Myopia And Other Ocular Conditions Using Singlet Oxygen Generated From Dyes Activated By Near-Infrared Light CALIFORNIA INSTITUTE OF TECHNOLOGY 2020-04-30 — — US claimed
EP-2336315-B1 Enzymatic encoding methods for efficient synthesis of large libraries NUEVOLUTION AS (DK) 2017-07-19 — — EP claimed
EP-2336315-A2 Enzymatic encoding methods for efficient synthesis of large libraries Nuevolution A/S (DK) 2011-06-22 — — EP claimed
US-12466958-B2 Coloring composition, ink jet recording method, image recorded material, and coloring agent compound FUJIFILM CORPORATION (JP) 2025-11-11 — — US disclosed
CN-115989214-B Pigment composition, inkjet recording method, image recorded matter, and pigment compound 富士胶片株式会社 2025-02-25 — — CN disclosed
CN-119371848-A Inkjet ink and inkjet recording method 富士胶片株式会社 2025-01-28 — — CN disclosed
US-12078828-B2 Laminate, optical filter, solid image pickup element, image display device, infrared sensor, and kit FUJIFILM CORPORATION (JP) 2024-09-03 — — US disclosed
EP-3410162-B1 COMPOSITION, FILM, NEAR-INFRARED CUTOFF FILTER, LAMINATE, PATTERN FORMATION METHOD, SOLID-STATE IMAGE SENSOR, IMAGE DISPLAY DEVICE, INFRARED SENSOR AND COLOR FILTER FUJIFILM CORP (JP) 2024-08-28 — — EP disclosed
US-11886112-B2 Curable composition, near infrared absorber, film, near infrared cut filter, solid-state imaging element, image display device, and infrared sensor FUJIFILM CORPORATION (JP) 2024-01-30 — — US disclosed
US-11702546-B2 Near-infrared heptamethine dyes for generation of singlet oxygen CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2023-07-18 — — US disclosed
US-20020171606-A1 Optical filter having filter layer containing infrared absorbing dye and ultraviolet absorbing agent FUJIFILM CORPORATION (JP) 2002-11-21 — — US disclosed
US-20020076666-A1 Methine compound and silver halide photographic material containing the same FUJI PHOTO FILM CO., LTD. 2002-06-20 — — US disclosed
US-20020075580-A1 Optical filter and image display FUJIFILM HOLDINGS CORPORATION (JP) 2002-06-20 — — US disclosed
US-20020050783-A1 Electromagnetic-wave-shielding film, production method thereof and image display device using the same FUJI PHOTO FILM CO., LTD. (JP) 2002-05-02 — — US disclosed
US-20020017636-A1 Optical filter comprising transparent support and filter layer having three absorption maximums FUJIFILM CORPORATION (JP) 2002-02-14 — — US disclosed
US-6333146-B1 METHINE DYE WHICH IS USEFUL AS A COLORING AGENT, A LIGHT ABSORBER, A DYE FOR AN OPTICAL DISC, SPECTRAL SENSITIZING DYES FOR A SILVER HALIDE PHOTOGRAPH, AN ELECTROPHOTOGRAPH AND A PHOTOELECTRIC CONVERSION DEVICE, OR A MARKER FOR DIAGNOSIS FUJI PHOTO FILM CO., LTD. (JP) 2001-12-25 — — US disclosed
US-20010053034-A1 Optical filter having two absorption maximums FUJIFILM CORPORATION (JP) 2001-12-20 — — 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 (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-20020076666-A1 Methine compound and silver halide photographic material containing the same PYM1, NPM1, METTL3 KIF11 1861/4885TDO2 2593/4885GABRP 3378/4885
US-20200129620-A1 Treatment Of Myopia And Other Ocular Conditions Using Singlet Oxygen Generated From Dyes Activated By Near-Infrared Light CRY1, MYH10, MYLK KIF11 790/4885TDO2 329/4885GABRP 4444/4885
US-20230173071-A1 TREATMENT OF MYOPIA AND OTHER OCULAR CONDITIONS USING SINGLET OXYGEN GENERATED FROM DYES ACTIVATED BY NEAR-INFRARED LIGHT CRY1, MYH10, MYLK KIF11 790/4885TDO2 329/4885GABRP 4444/4885

“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.

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