SCHEMBL12372828

SCHEMBL12372828

Nc1ccc(-c2ccc(-c3ccccc3)s2)cc1

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 5/20 0.81
▸ CYP3A4 P08684 4/20 0.64
▸ TDP1 Q9NUW8 2/20 0.64
▸ HSD17B10 Q99714 2/20 0.64
▸ TAAR1 Q96RJ0 1/20 0.64
▸ NQO2 P16083 2/20 0.57
▸ CYP2C9 P11712 2/20 0.52
▸ CYP2C19 P33261 2/20 0.52
▸ HSD17B1 P14061 2/20 0.52
▸ HSD17B2 P37059 2/20 0.52
▸ CYP2E1 P05181 1/20 0.52
▸ CYP2A6 P11509 1/20 0.52
▸ CYP2B6 P20813 1/20 0.52
▸ ALDH1A1 P00352 4/20 0.48
▸ KDM4E B2RXH2 2/20 0.48
▸ CYP1A2 P05177 1/20 0.48
▸ GAA P10253 1/20 0.48
▸ CYP2D6 P10635 1/20 0.48
▸ MEN1 O00255 3/20 0.48
▸ RAB9A P51151 3/20 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
SCHEMBL6751854 0.90 APP (1.00) APPCYP3A4TDP1HSD17B10TAAR1
SCHEMBL7587610 0.87 HSD17B1 (0.62) APPCYP3A4NQO2CYP2C9CYP2C19
SCHEMBL14190035 0.87 HSD17B1 (0.62) APPCYP3A4NQO2CYP2C9CYP2C19
SCHEMBL12562751 0.85 MEN1 (0.61) APPCYP3A4TDP1HSD17B10TAAR1
SCHEMBL560206 0.85 MEN1 (0.61) APPCYP3A4TDP1HSD17B10TAAR1
SCHEMBL14190049 0.85 MEN1 (0.61) APPCYP3A4TDP1HSD17B10TAAR1
SCHEMBL498650 0.84 HSD17B1 (0.65) APPCYP3A4NQO2CYP2C9CYP2C19
SCHEMBL13304737 0.82 APP (0.55) APPCYP3A4TDP1HSD17B10TAAR1
SCHEMBL7591626 0.82 RAB9A (0.59) APPCYP3A4TAAR1NQO2CYP2C9
SCHEMBL12562754 0.82 RAB9A (0.59) APPCYP3A4TAAR1NQO2CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106410031-B Organic solar cell with adjustable incident light intensity and preparation method thereof 上海大学 2020-01-17 — — CN claimed
CN-116963570-A Double perovskite 牛津大学科技创新有限公司 2023-10-27 — — CN disclosed
CN-116716104-A Preparation method of A/M/X material and photoelectric device 牛津大学科技创新有限公司 2023-09-08 — — CN disclosed
CN-108028320-B Double perovskite 牛津大学科技创新有限公司 2023-08-11 — — CN disclosed
CN-114195729-B Benzotriazine single free radical compound and preparation method thereof 郑州大学 2023-06-30 — — CN disclosed
EP-4052310-A1 METHOD FOR PRODUCING A LIGHT-EMITTING DIODE HAVING POLARIZED EMISSION Fraunhofer-Gesellschaft zur Förderung der angewandten Forschung e.V. (DE) 2022-09-07 — — EP disclosed
CN-114613805-A Multi-junction photovoltaic device 牛津光电有限公司 2022-06-10 — — CN disclosed
CN-107924933-B Multi-junction photovoltaic device 牛津光电有限公司 2022-04-15 — — CN disclosed
CN-114195729-A Benzotriazine single-free-radical compound and preparation method thereof 郑州大学 2022-03-18 — — CN disclosed
CN-113659081-A Method for depositing perovskite material 牛津光伏有限公司 2021-11-16 — — CN disclosed
US-9112167-B2 Aromatic amine derivatives and organic electroluminescent device using same IDEMITSU KOSAN COMPANY, LIMITED (JP) 2015-08-18 — — US disclosed
US-9112167-B2 Aromatic amine derivatives and organic electroluminescent device using same IDEMITSU KOSAN COMPANY, LIMITED (JP) 2015-08-18 — — US disclosed
US-20140077200-A1 AROMATIC AMINE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME SONY CORPORATION (JP) 2014-03-20 — — US disclosed
US-20140077200-A1 AROMATIC AMINE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME SONY CORPORATION (JP) 2014-03-20 — — US disclosed
US-20140054571-A1 Electroluminescent Element, Display Device And Method For Preparing Electroluminescent Element BOE TECHNOLOGY GROUP CO., LTD. (CN) 2014-02-27 — — US disclosed
CN-102097593-B Organic solar battery having phosphorescent material-doped donor layer UNIV JILIN 2012-11-28 — — CN disclosed
US-7998596-B2 Aromatic amine derivative and organic electroluminescence device using the same IDEMITSU KOSAN CO., LTD. (JP) 2011-08-16 — — US disclosed
US-7998596-B2 Aromatic amine derivative and organic electroluminescence device using the same IDEMITSU KOSAN CO., LTD. (JP) 2011-08-16 — — US disclosed
US-20090066235-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2009-03-12 — — US disclosed
US-20090066235-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2009-03-12 — — 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 (1 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-20090066235-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME DDC, TYR, EML4 APP 770/4885CYP3A4 595/4885TDP1 413/4885

“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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