Sugi Predict

Sugi Predict / Compounds / SCHEMBL329162

SCHEMBL329162

SCHEMBL329162

Cc1cccc([N+](=O)[O-])c1C(=O)OC(=O)c1c(C)cccc1[N+](=O)[O-]

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 6/20 0.70
▸ L3MBTL1 Q9Y468 2/20 0.70
▸ TSHR P16473 4/20 0.55
▸ SMN1; SMN2 Q16637 3/20 0.55
▸ HSD17B10 Q99714 2/20 0.53
▸ ALDH1A1 P00352 5/20 0.46
▸ GPR35 Q9HC97 2/20 0.46
▸ KCNMA1 Q12791 1/20 0.43
▸ CRHBP P24387 1/20 0.43
▸ CRHR2 Q13324 1/20 0.43
▸ KMT2A Q03164 2/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ KDM4E B2RXH2 2/20 0.41
▸ MAPT P10636 2/20 0.41
▸ MAPK1 P28482 2/20 0.41
▸ PKM P14618 1/20 0.41
▸ ABCC4 O15439 1/20 0.40
▸ PLIN1 O60240 1/20 0.40

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
SCHEMBL29627171 1.00 TDP1 (0.70) TDP1L3MBTL1TSHRSMN1; SMN2HSD17B10
SCHEMBL16838391 0.98 TDP1 (0.68) TDP1L3MBTL1TSHRSMN1; SMN2HSD17B10
SCHEMBL19079071 0.92 TDP1 (0.60) TDP1L3MBTL1TSHRSMN1; SMN2HSD17B10
SCHEMBL17343648 0.91 TDP1 (0.59) TDP1L3MBTL1TSHRSMN1; SMN2HSD17B10
SCHEMBL19078601 0.91 TDP1 (0.59) TDP1L3MBTL1TSHRSMN1; SMN2HSD17B10
SCHEMBL329163 0.91 TDP1 (0.63) TDP1L3MBTL1TSHRSMN1; SMN2HSD17B10
SCHEMBL283363 0.88 TDP1 (0.68) TDP1L3MBTL1TSHRSMN1; SMN2HSD17B10
SCHEMBL16466984 0.87 TDP1 (0.55) TDP1L3MBTL1TSHRSMN1; SMN2HSD17B10
SCHEMBL5764011 0.85 TDP1 (0.64) TDP1L3MBTL1TSHRSMN1; SMN2HSD17B10
SCHEMBL28124773 0.84 TDP1 (0.55) TDP1L3MBTL1TSHRSMN1; SMN2HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119462824-A Preparation method of sulfur-containing marine natural product Sunshinamide 复旦大学 2025-02-18 — — CN claimed
CN-119199094-A Carboxylated nano microsphere for coupling antibody and preparation method and application thereof 上海睿康生物科技有限公司 2024-12-27 — — CN claimed
CN-118206496-A Method for preparing uracil compound containing carboxylic ester fragment under acidic condition 江苏中旗科技股份有限公司 2024-06-18 — — CN claimed
CN-118026985-A Continuous foaming type concrete air entraining agent and preparation method thereof 江苏奥莱特新材料股份有限公司 2024-05-14 — — CN claimed
CN-111433211-B Synthesis of halichondrin 哈佛大学的校长及成员们 2024-05-07 — — CN claimed
CN-117623838-A Chiral sulfoxide ester compound and preparation method thereof 贵州大学 2024-03-01 — — CN claimed
CN-117384342-A Plant polyol, preparation method and application 广东腐蚀科学与技术创新研究院 2024-01-12 — — CN claimed
CN-116874504-A Artemether derivative and preparation method and application thereof 广东医科大学 2023-10-13 — — CN claimed
CN-115611907-A Textile fiber with chlorophyll extract modification 坤恩新材料(广州)有限公司 2023-01-17 — — CN claimed
US-20210230177-A1 SYNTHESIS OF HALICHONDRINS PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2021-07-29 — — US claimed
WO-2019010363-A1 SYNTHESIS OF HALICHONDRINS PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2019-01-10 — — WO claimed
US-20180273819-A1 THERMAL ENERGY STORAGE PHASE AND TEMPERATURE STABILIZATION CHANGE MATERIALS COMPRISING TRIAMINES AND METHODS FOR MAKING AND USING THEM ENTROPY SOLUTIONS LLC (US) 2018-09-27 — — US claimed
EP-3106477-B1 (METH)ACRYLIC ACID ESTER COMPOUND AND PRODUCTION METHOD THEREFOR MITSUBISHI GAS CHEMICAL CO (JP) 2018-08-29 — — EP claimed
US-10005714-B2 (Meth)acrylic acid ester compound and production method therefor MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2018-06-26 — — US claimed
EP-3214088-A1 METHOD FOR PRODUCING EUSHEARILIDES Tokyo University of Science Foundation (JP) 2017-09-06 — — EP claimed
US-20170008830-A1 (METH)ACRYLIC ACID ESTER COMPOUND AND PRODUCTION METHOD THEREFOR MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2017-01-12 — — US claimed
EP-3106477-A1 (METH)ACRYLIC ACID ESTER COMPOUND AND PRODUCTION METHOD THEREFOR Mitsubishi Gas Chemical Company, Inc. (JP) 2016-12-21 — — EP claimed
WO-2016179028-A1 THERMAL ENERGY STORAGE PHASE AND TEMPERATURE STABILIZATION CHANGE MATERIALS AND METHODS FOR MAKING AND USING THEM ENTROPY SOLUTIONS, LLC. (US) 2016-11-10 — — WO claimed
WO-2016116788-A1 NITROGEN CONTAINING BICYCLIC COMPOUNDS AND THEIR USE IN TREATMENT OF BACTERIAL INFECTIONS WOCKHARDT LIMITED (IN) 2016-07-28 — — WO claimed
US-7915418-B2 Intermediates and process for the production of optically active quinolonecarboxylic acid derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2011-03-29 — — US claimed

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-10005714-B2 (Meth)acrylic acid ester compound and production method therefor AMD1, ALDH7A1, TMEM164 TDP1 818/4885L3MBTL1 3475/4885TSHR 3202/4885
US-20170008830-A1 (METH)ACRYLIC ACID ESTER COMPOUND AND PRODUCTION METHOD THEREFOR AMD1, ALDH7A1, TMEM164 TDP1 989/4885L3MBTL1 3675/4885TSHR 3165/4885
US-20210230177-A1 SYNTHESIS OF HALICHONDRINS H1-3, NISCH, HDAC11 TDP1 4626/4885L3MBTL1 3268/4885TSHR 3423/4885

“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.