Sugi Predict

Sugi Predict / Compounds / SCHEMBL625577

SCHEMBL625577

SCHEMBL625577

O=C(O)c1ccccc1[N+](=O)[O-].[KH]

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.65
▸ ALDH1A1 P00352 3/20 0.63
▸ CTSD P07339 1/20 0.59
▸ KDM4E B2RXH2 2/20 0.57
▸ GAA P10253 2/20 0.57
▸ MAPT P10636 2/20 0.57
▸ MEN1 O00255 1/20 0.57
▸ KMT2A Q03164 1/20 0.57
▸ DTYMK P23919 1/20 0.53
▸ ALOX15 P16050 1/20 0.52
▸ CYP1A2 P05177 1/20 0.51
▸ CYP3A4 P08684 1/20 0.51
▸ CYP2D6 P10635 1/20 0.51
▸ CYP2C9 P11712 1/20 0.51
▸ CYP2C19 P33261 1/20 0.51
▸ TDP1 Q9NUW8 2/20 0.50
▸ ALPL P05186 1/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.50
▸ HTT P42858 1/20 0.50
▸ NCOA1 Q15788 1/20 0.50

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
SCHEMBL1931700 0.98 TSHR (0.62) TSHRALDH1A1CTSDKDM4EGAA
SCHEMBL29696138 0.98 TSHR (0.67) TSHRALDH1A1CTSDKDM4EGAA
SCHEMBL30727560 0.98 TSHR (0.67) TSHRALDH1A1CTSDKDM4EGAA
SCHEMBL78205 0.98 TSHR (0.67) TSHRALDH1A1CTSDKDM4EGAA
SCHEMBL20377950 0.96 TSHR (0.65) TSHRALDH1A1CTSDKDM4EGAA
SCHEMBL4588668 0.96 TSHR (0.65) TSHRALDH1A1CTSDKDM4EGAA
Ammonia Solution, Strong SCHEMBL11058598 0.96 TSHR (0.65) TSHRALDH1A1CTSDKDM4EGAA
SCHEMBL6391676 0.96 TSHR (0.65) TSHRALDH1A1CTSDKDM4EGAA
SCHEMBL9125306 0.96 TSHR (0.65) TSHRALDH1A1CTSDKDM4EGAA
Potassium Ion SCHEMBL625575 0.96 TSHR (0.65) TSHRALDH1A1CTSDKDM4EGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10995365-B2 Compounds and systems for improving signal detection PACIFIC BIOSCIENCES OF CALIFORNIA, INC. 2021-05-04 — — US disclosed
EP-3350350-B1 COMPOUNDS AND SYSTEMS FOR IMPROVING SIGNAL DETECTION PACIFIC BIOSCIENCES CALIFORNIA INC (US) 2021-04-14 — — EP disclosed
US-10906860-B2 Method for synthesizing chiral beta-hydroxy acid ester compound WENZHOU UNIVERSITY (CN) 2021-02-02 — — US disclosed
US-20200190013-A1 METHOD FOR SYNTHESIZING CHIRAL BETA-HYDROXY ACID ESTER COMPOUND WENZHOU UNIVERSITY (CN) 2020-06-18 — — US disclosed
US-10435741-B2 Compounds and systems for improving signal detection PACIFIC BIOSCIENCES OF CALIFORNIA, INC. (US) 2019-10-08 — — US disclosed
CN-109734600-A A kind of synthetic method of chiral beta carboxylic acid ester type compound 温州大学 2019-05-10 — — CN disclosed
US-20190106742-A1 COMPOUNDS AND SYSTEMS FOR IMPROVING SIGNAL DETECTION PACIFIC BIOSCIENCES CALIFORNIA INC (US) 2019-04-11 — — US disclosed
EP-3350350-A1 COMPOUNDS AND SYSTEMS FOR IMPROVING SIGNAL DETECTION Pacific Biosciences of California, Inc. (US) 2018-07-25 — — EP disclosed
CN-107628956-A The method of one kind synthesis aminobphenyl of 3,4 difluoro 2 ' 江西天宇化工有限公司 2018-01-26 — — CN disclosed
CN-107488113-A A kind of method for synthesizing o-aminobiphenyl class compound 上海泰禾国际贸易有限公司 2017-12-19 — — CN disclosed
US-20170145494-A1 COMPOUNDS AND SYSTEMS FOR IMPROVING SIGNAL DETECTION PACIFIC BIOSCIENCES OF CALIFORNIA, INC. 2017-05-25 — — US disclosed
CN-105732392-A Method for preparing 4'-chloro-2-nitrobiphenyl 天津市均凯化工科技有限公司 2016-07-06 — — CN disclosed
CN-104557646-A Industrial methods for producing arylsulfur pentafluorides UBE INDUSTRIES 2015-04-29 — — CN disclosed
US-20150079603-A1 PHOTODAMAGE MITIGATION COMPOUNDS AND SYSTEMS PACIFIC BIOSCIENCES CALIFORNIA (US) 2015-03-19 — — US disclosed
US-8834847-B2 Photodamage mitigation compounds and systems PACIFIC BIOSCIENCES OF CALIFORNIA, INC. (US) 2014-09-16 — — US disclosed
CN-103380110-A Industrial process for the production of arylsulfur pentafluorides UBE INDUSTRIES 2013-10-30 — — CN disclosed
CN-101522742-B method for preparing viscoelastic polyurethane foam material DOW GLOBAL TECHNOLOGIES INC 2012-07-04 — — CN disclosed
US-20120052488-A1 PHOTODAMAGE MITIGATION COMPOUNDS AND SYSTEMS PACIFIC BIOSCIENCES OF CALIFORNIA, INC. (US) 2012-03-01 — — US disclosed
WO-2012021733-A2 PHOTODAMAGE MITIGATION COMPOUNDS AND SYSTEMS PACIFIC BIOSCIENCES OF CALIFORNIA, INC. (US) 2012-02-16 — — WO disclosed
CN-101522742-A Method for preparing viscoelastic polyurethane foam material DOW GLOBAL TECHNOLOGIES INC (US) 2009-09-02 — — CN 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-20200190013-A1 METHOD FOR SYNTHESIZING CHIRAL BETA-HYDROXY ACID ESTER COMPOUND HSD11B1, HACL2, HAAO TSHR 4393/4885ALDH1A1 30/4885CTSD 2712/4885
US-20120052488-A1 PHOTODAMAGE MITIGATION COMPOUNDS AND SYSTEMS CRY1, ERCC1, ERCC4 TSHR 3233/4885ALDH1A1 814/4885CTSD 1959/4885
US-10906860-B2 Method for synthesizing chiral beta-hydroxy acid ester compound HSD11B1, HACL2, HAAO TSHR 4393/4885ALDH1A1 30/4885CTSD 2712/4885

“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.