SCHEMBL113286

SCHEMBL113286

Cc1c(F)cc(N)c(OCc2ccccc2)c1C(=O)Oc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.42
LMNA P02545 2/20 0.41
HPGD P15428 1/20 0.41
TSHR P16473 1/20 0.40
MAOB P27338 2/20 0.40
FFAR4 Q5NUL3 1/20 0.39
NR4A2 P43354 1/20 0.39
KDM4E B2RXH2 1/20 0.38
TP53 P04637 1/20 0.38
CYP3A4 P08684 1/20 0.38
ADORA3 P0DMS8 1/20 0.38
MAPT P10636 1/20 0.38
CHRM1 P11229 1/20 0.38
TBXA2R P21731 1/20 0.38
SLC6A2 P23975 1/20 0.38
PDE4A P27815 1/20 0.38
ADRA1A P35348 1/20 0.38
KDR P35968 1/20 0.38
SLC6A3 Q01959 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL9279822 0.89 PTPN1 (0.44) PTPN1LMNAHPGDMAOBFFAR4
SCHEMBL6125199 0.89 PTPN1 (0.47) PTPN1LMNAHPGDMAOBFFAR4
SCHEMBL114105 0.86 THRA (0.46) PTPN1LMNAHPGDMAOBFFAR4
SCHEMBL9283029 0.86 KDM4E (0.46) PTPN1LMNAHPGDMAOBFFAR4
SCHEMBL6128435 0.85 FAAH (0.40) LMNATSHRTP53CYP3A4ADORA3
SCHEMBL1534047 0.85 PTPN1 (0.44) PTPN1LMNAHPGDTSHRMAOB
SCHEMBL19035748 0.84 LMNA (0.43) PTPN1LMNAHPGDMAOBFFAR4
SCHEMBL1534080 0.84 RXRA (0.41) PTPN1LMNAHPGDTSHRMAOB
SCHEMBL113438 0.82 TSPO (0.41) PTPN1LMNAHPGDMAOBFFAR4
SCHEMBL114286 0.82 PTGES (0.45) PTPN1LMNAHPGDMAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230122651-A1 C7-FLUORO SUBSTITUTED TETRACYCLINE COMPOUNDS TETRAPHASE PHARMACEUTICALS INC (US) 2023-04-20 US disclosed
CN-115448849-B Preparation method of 2-benzyloxy-3-dibenzylamino-5-fluoro-6-methylbenzoic acid phenyl ester 苏州富士莱医药股份有限公司 2023-02-03 CN disclosed
CN-115448849-A Preparation method of 2-benzyloxy-3-dibenzylamino-5-fluoro-6-methyl benzoate 苏州富士莱医药股份有限公司 2022-12-09 CN disclosed
US-20210122709-A1 C7-FLUORO SUBSTITUTED TETRACYCLINE COMPOUNDS TETRAPHASE PHARMACEUTICALS INC (US) 2021-04-29 US disclosed
US-10913712-B2 Tetracycline compounds TETRAPHASE PHARMACEUTICALS, INC. (US) 2021-02-09 US disclosed
US-20200055813-A1 C7-FLUORO SUBSTITUTED TETRACYCLINE COMPOUNDS TETRAPHASE PHARMACEUTICALS, INC. 2020-02-20 US disclosed
US-20200048193-A1 TETRACYCLINE COMPOUNDS TETRAPHASE PHARMACEUTICALS, INC. 2020-02-13 US disclosed
US-10315992-B2 Tetracyline compounds TETRAPHASE PHARMACEUTICALS, INC. (US) 2019-06-11 US disclosed
EP-3461809-A1 TETRACYCLINE COMPOUNDS Tetraphase Pharmaceuticals, Inc. (US) 2019-04-03 EP disclosed
US-20190077803-A1 TETRACYCLINE COMPOUNDS TETRAPHASE PHARMACEUTICALS INC (US) 2019-03-14 US disclosed
US-8501716-B2 C7-fluoro substituted tetracycline compounds TETRAPHASE PHARMACEUTICALS, INC. (US) 2013-08-06 US disclosed
US-20130109657-A1 C7-Fluoro Substituted Tetracycline Compounds TETRAPHASE PHARMACEUTICALS, INC. (US) 2013-05-02 US disclosed
US-20120302527-A1 C7-Fluoro Substituted Tetracycline Compounds TETRAPHASE PHARMACEUTICALS, INC. (US) 2012-11-29 US disclosed
US-20120135968-A1 Tetracycline Compounds TETRAPHASE PHARMACEUTICALS, INC. 2012-05-31 US disclosed
US-20120115818-A1 SYNTHESIS OF TETRACYCLINES AND INTERMEDIATES THERETO PRESIDENT AND FELOWS OF HARVARD COLLEGE (US) 2012-05-10 US disclosed
US-20120115818-A1 SYNTHESIS OF TETRACYCLINES AND INTERMEDIATES THERETO PRESIDENT AND FELOWS OF HARVARD COLLEGE (US) 2012-05-10 US disclosed
EP-2424834-A2 SYNTHESIS OF TETRACYCLINES AND INTERMEDIATES THERETO President and Fellows of Harvard College (US) 2012-03-07 EP disclosed
US-20110269714-A1 Polycyclic Tetracycline Compounds TETRAPHASE PHARMACEUTICALS, INC. (US) 2011-11-03 US disclosed
WO-2010126607-A2 SYNTHESIS OF TETRACYCLINES AND INTERMEDIATES THERETO PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2010-11-04 WO disclosed
US-20100105671-A1 C7-fluoro substituted tetracycline compounds TETRAPHASE PHARMACEUTICALS, INC. 2010-04-29 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 (13 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-20120115818-A1 SYNTHESIS OF TETRACYCLINES AND INTERMEDIATES THERETO TET1, TET3, TYMS PTPN1 2298/4885LMNA 1424/4885HPGD 1380/4885
US-20200055813-A1 C7-FLUORO SUBSTITUTED TETRACYCLINE COMPOUNDS F7, TUBA1C, TUBA4A PTPN1 654/4885LMNA 2405/4885HPGD 4789/4885
US-10913712-B2 Tetracycline compounds TREH, TUBB, TUBB6 PTPN1 335/4885LMNA 3490/4885HPGD 2798/4885
US-20100105671-A1 C7-fluoro substituted tetracycline compounds F7, TUBA1C, TUBA4A PTPN1 654/4885LMNA 2405/4885HPGD 4789/4885
US-20120302527-A1 C7-Fluoro Substituted Tetracycline Compounds F7, TUBA1C, TUBA4A PTPN1 654/4885LMNA 2405/4885HPGD 4789/4885
US-20110269714-A1 Polycyclic Tetracycline Compounds TET1, TUBA1C, TUBB PTPN1 470/4885LMNA 2586/4885HPGD 3299/4885
US-20200048193-A1 TETRACYCLINE COMPOUNDS TREH, TUBB, TUBB6 PTPN1 335/4885LMNA 3490/4885HPGD 2798/4885
US-20230122651-A1 C7-FLUORO SUBSTITUTED TETRACYCLINE COMPOUNDS F7, TUBA1C, TUBA4A PTPN1 654/4885LMNA 2405/4885HPGD 4789/4885
US-20120135968-A1 Tetracycline Compounds TUBB, TUBA1C, TUBA1A PTPN1 402/4885LMNA 3089/4885HPGD 2557/4885
US-20190077803-A1 TETRACYCLINE COMPOUNDS TUBB, TUBA1C, TUBA1A PTPN1 402/4885LMNA 3089/4885HPGD 2557/4885
US-10315992-B2 Tetracyline compounds SLC10A1, CYP3A7, TAAR5 PTPN1 824/4885LMNA 3834/4885HPGD 4058/4885
US-20130109657-A1 C7-Fluoro Substituted Tetracycline Compounds F7, TUBA1C, TUBA4A PTPN1 654/4885LMNA 2405/4885HPGD 4789/4885
US-20210122709-A1 C7-FLUORO SUBSTITUTED TETRACYCLINE COMPOUNDS F7, TUBA1C, TUBA4A PTPN1 654/4885LMNA 2405/4885HPGD 4789/4885

“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.