SCHEMBL9360610

SCHEMBL9360610

CCCCCCOc1ccc(C=C(C#N)C(=O)O)cc1

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PTGES O14684 1/20 0.55
▸ TP53 P04637 1/20 0.54
▸ TSHR P16473 1/20 0.54
▸ CISD1 Q9NZ45 1/20 0.52
▸ KDM4E B2RXH2 1/20 0.52
▸ SLC16A3 O15427 1/20 0.52
▸ ALDH1A1 P00352 1/20 0.52
▸ CYP3A4 P08684 1/20 0.52
▸ HPGD P15428 1/20 0.52
▸ SLC16A1 P53985 1/20 0.52
▸ GPR35 Q9HC97 1/20 0.52
▸ EGFR P00533 1/20 0.52

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
SCHEMBL9361312 1.00 PTGES (0.55) PTGESTP53TSHRCISD1KDM4E
SCHEMBL9360606 1.00 PTGES (0.55) PTGESTP53TSHRCISD1KDM4E
SCHEMBL29918400 1.00 PTGES (0.55) PTGESTP53TSHRCISD1KDM4E
SCHEMBL9361056 0.99 CISD1 (0.54) PTGESCISD1KDM4ESLC16A3ALDH1A1
SCHEMBL9361052 0.99 CISD1 (0.54) PTGESCISD1KDM4ESLC16A3ALDH1A1
SCHEMBL9365514 0.96 CISD1 (0.56) CISD1KDM4ESLC16A3ALDH1A1CYP3A4
SCHEMBL9365521 0.96 CISD1 (0.56) CISD1KDM4ESLC16A3ALDH1A1CYP3A4
SCHEMBL12296669 0.93 PTGES (0.52) PTGESCISD1KDM4ESLC16A3ALDH1A1
SCHEMBL21572153 0.93 PTGES (0.52) PTGESCISD1KDM4ESLC16A3ALDH1A1
SCHEMBL21561423 0.93 PTGES (0.52) PTGESCISD1KDM4ESLC16A3ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11802106-B2 Cathode buffer layer material and organic or organic/inorganic hybrid photoelectric device comprising same KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2023-10-31 — — US claimed
US-20210198188-A1 NOVEL CATHODE BUFFER LAYER MATERIAL AND ORGANIC OR ORGANIC/INORGANIC HYBRID PHOTOELECTRIC DEVICE COMPRISING SAME KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2021-07-01 — — US claimed
WO-2020017739-A1 NOVEL CATHODE BUFFER LAYER MATERIAL AND ORGANIC OR ORGANIC/INORGANIC HYBRID PHOTOELECTRIC DEVICE COMPRISING SAME 한국화학연구원 2020-01-23 — — WO claimed
US-11802106-B2 Cathode buffer layer material and organic or organic/inorganic hybrid photoelectric device comprising same KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2023-10-31 — — US disclosed
US-20210198188-A1 NOVEL CATHODE BUFFER LAYER MATERIAL AND ORGANIC OR ORGANIC/INORGANIC HYBRID PHOTOELECTRIC DEVICE COMPRISING SAME KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2021-07-01 — — US disclosed
WO-2020017739-A1 NOVEL CATHODE BUFFER LAYER MATERIAL AND ORGANIC OR ORGANIC/INORGANIC HYBRID PHOTOELECTRIC DEVICE COMPRISING SAME 한국화학연구원 2020-01-23 — — WO disclosed
EP-0335641-B1 Organic nonlinear optical substance TEIJIN LTD (JP) 1994-01-05 — — EP disclosed
US-5196147-A Optical crystals TEIJIN LIMITED (JP) 1993-03-23 — — US disclosed
EP-0335641-A2 Organic nonlinear optical substance TEIJIN LIMITED (JP) 1989-10-04 — — 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-11802106-B2 Cathode buffer layer material and organic or organic/inorganic hybrid photoelectric device comprising same DCX, CDH1, CACNA2D3 PTGES 4547/4885TP53 1973/4885TSHR 4282/4885
US-20210198188-A1 NOVEL CATHODE BUFFER LAYER MATERIAL AND ORGANIC OR ORGANIC/INORGANIC HYBRID PHOTOELECTRIC DEVICE COMPRISING SAME DCX, HCN3, CDH1 PTGES 4608/4885TP53 1756/4885TSHR 4369/4885

“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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