SCHEMBL1354118

SCHEMBL1354118

CCCCSc1ccc2c3c(cccc13)C(=O)OC2=O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TYMS P04818 5/20 0.60
▸ FGFR1 P11362 3/20 0.42
▸ SOAT1 P35610 7/20 0.40
▸ S100A4 P26447 1/20 0.40
▸ BCL2 P10415 3/20 0.38
▸ BCL2L1 Q07817 2/20 0.38
▸ MCL1 Q07820 2/20 0.38
▸ PTGS2 P35354 1/20 0.38
▸ MEN1 O00255 1/20 0.37
▸ RGS12 O14924 1/20 0.37
▸ USP2 O75604 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ ATM Q13315 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ TLR9 Q9NR96 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL11345920 0.94 TYMS (0.57) TYMSFGFR1SOAT1BCL2BCL2L1
SCHEMBL13829100 0.94 TYMS (0.57) TYMSFGFR1SOAT1BCL2BCL2L1
SCHEMBL17617816 0.91 TYMS (0.62) TYMSFGFR1SOAT1BCL2BCL2L1
SCHEMBL6516581 0.82 TYMS (0.59) TYMSFGFR1S100A4BCL2MEN1
SCHEMBL13829366 0.82 KMT2A (0.50) TYMSFGFR1SOAT1S100A4PTGS2
SCHEMBL13829210 0.80 TYMS (0.60) TYMSFGFR1BCL2PTGS2MEN1
SCHEMBL13829269 0.79 TYMS (0.59) TYMSFGFR1BCL2MEN1USP2
SCHEMBL13829120 0.78 POLB (0.48) TYMSFGFR1SOAT1PTGS2MEN1
SCHEMBL9450619 0.77 KDM4E (0.50) TYMSMEN1USP2POLBMAPT
SCHEMBL12133954 0.76 POLB (0.55) FGFR1MEN1RGS12USP2POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2524914-B1 SULFONIC ACID DERIVATIVE COMPOUND AND NAPHTHALIC ACID DERIVATIVE COMPOUND ADEKA CORP (JP) 2019-07-03 — — EP disclosed
US-9518964-B2 Method for identifying electrophiles and nucleophiles in a sample EICHEN YOAV (IL) 2016-12-13 — — US disclosed
US-9518964-B2 Method for identifying electrophiles and nucleophiles in a sample EICHEN YOAV (IL) 2016-12-13 — — US disclosed
US-9518964-B2 Method for identifying electrophiles and nucleophiles in a sample EICHEN YOAV (IL) 2016-12-13 — — US disclosed
US-8680268-B2 Sulfonic acid derivative compound and novel naphthalic acid derivative compound ADEKA CORPORATION (JP) 2014-03-25 — — US disclosed
US-8680268-B2 Sulfonic acid derivative compound and novel naphthalic acid derivative compound ADEKA CORPORATION (JP) 2014-03-25 — — US disclosed
EP-2524914-A1 NOVEL SULFONIC ACID DERIVATIVE COMPOUND AND NOVEL NAPHTHALIC ACID DERIVATIVE COMPOUND Adeka Corporation (JP) 2012-11-21 — — EP disclosed
US-20120289697-A1 NOVEL SULFONIC ACID DERIVATIVE COMPOUND AND NOVEL NAPHTHALIC ACID DERIVATIVE COMPOUND ADEKA CORPORATION (JP) 2012-11-15 — — US disclosed
US-20120289697-A1 NOVEL SULFONIC ACID DERIVATIVE COMPOUND AND NOVEL NAPHTHALIC ACID DERIVATIVE COMPOUND ADEKA CORPORATION (JP) 2012-11-15 — — US disclosed
US-20110281742-A1 METHOD FOR IDENTIFYING ELECTROPHILES AND NUCLEOPHILES IN A SAMPLE EICHEN YOAV (IL) 2011-11-17 — — US disclosed
US-20110281742-A1 METHOD FOR IDENTIFYING ELECTROPHILES AND NUCLEOPHILES IN A SAMPLE EICHEN YOAV (IL) 2011-11-17 — — US disclosed
US-20110281742-A1 METHOD FOR IDENTIFYING ELECTROPHILES AND NUCLEOPHILES IN A SAMPLE EICHEN YOAV (IL) 2011-11-17 — — US disclosed
US-20090258430-A1 Method for identifying electrophiles and nucleophiles in a sample TECHNION RESEARCH & DEVELOPMENT FOUNDATION LTD. (IL) 2009-10-15 — — US disclosed
US-20090258430-A1 Method for identifying electrophiles and nucleophiles in a sample TECHNION RESEARCH & DEVELOPMENT FOUNDATION LTD. (IL) 2009-10-15 — — US disclosed
US-20090258430-A1 Method for identifying electrophiles and nucleophiles in a sample TECHNION RESEARCH & DEVELOPMENT FOUNDATION LTD. (IL) 2009-10-15 — — US disclosed
EP-2085766-A2 Method for identifying electrophiles and nucleophiles in a sample Technion Research and Development Foundation, Ltd. (IL) 2009-08-05 — — EP disclosed
EP-2085766-A2 Method for identifying electrophiles and nucleophiles in a sample Technion Research and Development Foundation, Ltd. (IL) 2009-08-05 — — 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 (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-20120289697-A1 NOVEL SULFONIC ACID DERIVATIVE COMPOUND AND NOVEL NAPHTHALIC ACID DERIVATIVE COMPOUND TPD52L2, TST, SULT1A1 TYMS 2935/4885FGFR1 119/4885SOAT1 2427/4885

“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.

Send feedback