SCHEMBL8866097

SCHEMBL8866097

Cc1cc([N+](=O)[O-])ccc1Sc1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE7A Q13946 6/20 0.68
TDP1 Q9NUW8 3/20 0.53
ALDH1A1 P00352 2/20 0.53
TSHR P16473 2/20 0.53
PDE7B Q9NP56 2/20 0.51
MAPT P10636 4/20 0.50
CYP3A4 P08684 3/20 0.50
PTGES O14684 1/20 0.50
PDE4B Q07343 1/20 0.49
PDE4D Q08499 1/20 0.49
TXNRD1 Q16881 1/20 0.49
TXNRD3 Q86VQ6 1/20 0.49
TXNRD2 Q9NNW7 1/20 0.49
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
CRHBP P24387 1/20 0.48
CYP2C19 P33261 1/20 0.48

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
SCHEMBL11557505 0.87 PDE7A (0.63) PDE7ATDP1ALDH1A1TSHRPDE7B
SCHEMBL7263676 0.86 ALDH1A1 (0.64) PDE7ATDP1ALDH1A1TSHRPDE7B
SCHEMBL28325601 0.84 PDE7A (0.57) PDE7ATDP1ALDH1A1TSHRPDE7B
SCHEMBL8865858 0.82 PDE7A (0.69) PDE7AALDH1A1PDE7BMAPTPTGES
SCHEMBL6039967 0.82 TXNRD1 (0.74) PDE7ATDP1ALDH1A1PDE7BMAPT
SCHEMBL18723786 0.81 PDE7A (0.46) PDE7ATDP1ALDH1A1PDE7BMAPT
SCHEMBL31336597 0.81 PDE7A (0.56) PDE7ATDP1ALDH1A1TSHRPDE7B
SCHEMBL28284302 0.81 GAA (0.53) PDE7ATDP1ALDH1A1TSHRPDE7B
SCHEMBL8308859 0.81 PDE7A (1.00) PDE7ATDP1ALDH1A1PDE7BMAPT
SCHEMBL8865840 0.80 PDE7A (0.62) PDE7ATDP1ALDH1A1PDE7BMAPT

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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113264856-B Sulfonium salt, photoacid generator, and photosensitive composition 东京应化工业株式会社 2022-11-22 CN disclosed
CN-107074759-B Sulfonium salt, photoacid generator, and photosensitive composition 东京应化工业株式会社 2021-12-14 CN disclosed
CN-113264856-A Sulfonium salt, photoacid generator, and photosensitive composition 东京应化工业株式会社 2021-08-17 CN disclosed
EP-3199520-B1 SULFONIUM SALT, PHOTOACID GENERATOR, AND PHOTOSENSITIVE COMPOSITION TOKYO OHKA KOGYO CO LTD (JP) 2019-12-25 EP disclosed
US-10059662-B2 Sulfonium salt, photoacid generator, and photosensitive composition TOKYO OHKA KOGYO CO., LTD. (JP) 2018-08-28 US disclosed
US-20170305848-A1 SULFONIUM SALT, PHOTOACID GENERATOR, AND PHOTOSENSITIVE COMPOSITION TOKYO OHKA KOGYO CO., LTD. (JP) 2017-10-26 US disclosed
EP-3199520-A1 SULFONIUM SALT, PHOTOACID GENERATOR, AND PHOTOSENSITIVE COMPOSITION Tokyo Ohka Kogyo Co., Ltd. (JP) 2017-08-02 EP disclosed
US-5684198-A N-ARYL-2-HYDROXYPROPANAMIDES IMPERIAL CHEMICAL INDUSTRIES, PLC (GB) 1997-11-04 US disclosed
US-5567735-A CELL POTASSIUM CHANNEL MODULATOR FOR TREATING ASTHMA IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1996-10-22 US disclosed
US-5565477-A TREATMENT OF URINARY INCONTINENCE IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1996-10-15 US disclosed
US-5565465-A TREATMENT OF URINARY INCONTINENCE IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1996-10-15 US disclosed
EP-0524781-B1 Therapeutic amides ZENECA LTD (GB) 1996-03-27 EP disclosed
US-5474999-A Useful in treatment of urinary incontinence IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1995-12-12 US disclosed
US-5382598-A Therapeutic amides IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1995-01-17 US disclosed
US-5272163-A Therapeutic amides IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-12-21 US disclosed
EP-0524781-A1 Therapeutic amides ZENECA LIMITED (GB) 1993-01-27 EP 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-20170305848-A1 SULFONIUM SALT, PHOTOACID GENERATOR, AND PHOTOSENSITIVE COMPOSITION ARSA, SPIN1, ASIC1 PDE7A 3046/4885TDP1 4091/4885ALDH1A1 2376/4885
US-10059662-B2 Sulfonium salt, photoacid generator, and photosensitive composition ARSA, SPIN1, ASIC1 PDE7A 3046/4885TDP1 4091/4885ALDH1A1 2376/4885

“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.