SCHEMBL5807658

SCHEMBL5807658

O=C(CS)N1CCOCC1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.59
TSHR P16473 3/20 0.54
ALOX15 P16050 1/20 0.54
HSD17B10 Q99714 1/20 0.54
SMN1; SMN2 Q16637 2/20 0.48
POLB P06746 2/20 0.48
GAA P10253 1/20 0.48
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA9 Q16790 1/20 0.48
GLA P06280 1/20 0.47
LMNA P02545 1/20 0.47
MEN1 O00255 1/20 0.46
TP53 P04637 1/20 0.46
KMT2A Q03164 1/20 0.46
FKBP1A P62942 2/20 0.46
ALDH1A1 P00352 1/20 0.46
HTT P42858 1/20 0.45
MMP1 P03956 1/20 0.45
MMP3 P08254 1/20 0.45

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
SCHEMBL11559490 0.82 ALDH1A1 (0.48) L3MBTL1TSHRALOX15HSD17B10SMN1; SMN2
SCHEMBL28856427 0.82
SCHEMBL3753324 0.80 L3MBTL1 (0.64) L3MBTL1TSHRALOX15HSD17B10SMN1; SMN2
SCHEMBL8218017 0.79 GLA (0.59) L3MBTL1TSHRALOX15HSD17B10SMN1; SMN2
SCHEMBL424000 0.78 L3MBTL1 (0.68) L3MBTL1TSHRALOX15HSD17B10SMN1; SMN2
SCHEMBL2262931 0.78 L3MBTL1 (0.61) L3MBTL1TSHRALOX15HSD17B10SMN1; SMN2
SCHEMBL423999 0.78 L3MBTL1 (0.61) L3MBTL1TSHRALOX15HSD17B10SMN1; SMN2
SCHEMBL13522679 0.78 L3MBTL1 (0.61) L3MBTL1TSHRALOX15HSD17B10SMN1; SMN2
SCHEMBL8133040 0.77
SCHEMBL4741470 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4379924-A Cephalosporin derivatives TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1983-04-12 US claimed
US-11789025-B2 Reagents and methods for analysis of proteins and metabolites targeted by covalent probes DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-10-17 US disclosed
US-11789025-B2 Reagents and methods for analysis of proteins and metabolites targeted by covalent probes DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-10-17 US disclosed
US-10969394-B2 Reagents and methods for analysis of proteins and metabolites targeted by covalent probes DANA-FARBER CANCER INSTITUTE, INC. (US) 2021-04-06 US disclosed
US-20210072254-A1 Reagents and Methods for Analysis of Proteins and Metabolites Targeted by Covalent Probes DANA-FARBER CANCER INSTITUTE, INC. 2021-03-11 US disclosed
EP-3426640-B1 PRMT5 INHIBITORS CTXT PTY LTD (AU) 2020-11-18 EP disclosed
EP-3426647-B1 TETRAHYDROISOQUINOLINES AS PRMT5-INHIBITORS CTXT PTY LTD (AU) 2020-11-18 EP disclosed
US-20190346454-A1 Reagents and Methods for Analysis of Proteins and Metabolites Targeted by Covalent Probes DANA-FARBER CANCER INSTITUTE, INC. 2019-11-14 US disclosed
WO-2017153515-A1 TETRAHYDROISOQUINOLINES AS PRMT5-INHIBITORS CTXT PTY LIMITED (AU) 2017-09-14 WO disclosed
WO-2017153513-A1 TETRAHYDROISOQUINOLINES AS PRMT5 INHIBITORS CTXT PTY LIMITED (AU) 2017-09-14 WO disclosed
US-4239758-A BACTERICIDES TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1980-12-16 US disclosed
US-4238608-A ANTIBIOTICS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1980-12-09 US disclosed
US-4224441-A Derivatives of 7-aminocephalosporanic acid TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1980-09-23 US disclosed
EP-0006011-A1 Cephalosporins and pharmaceutical compositions containing them Takeda Chemical Industries, Ltd. (JP) 1979-12-12 EP disclosed
US-4172891-A ANTIBIOTICS TAKEDA CHEMICAL INDUSTRIES, INC. (JP) 1979-10-30 US disclosed
US-4166178-A 3-ACYLOXYMETHYL-CEPHEM COMPOUNDS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1979-08-28 US disclosed
US-4080498-A ANTIBIOTICS, BACTERICIDES TAKEDA CHEMICAL INDUSTRIES, LTD. (JA) 1978-03-21 US disclosed
US-4068071-A DISULFIDING, SOLVOLYSIS TAKEDA CHEMICAL INDUSTRIES, LTD. (JA) 1978-01-10 US disclosed
US-4068072-A CHLORINATION OR BROMINATION, SOLVOLYSIS TAKEDA CHEMICAL INDUSTRIES, LTD. (JA) 1978-01-10 US disclosed
US-4012379-A 7-Acetoacetamidocephem compounds TAKEDA CHEMICAL INDUSTRIES, LTD. (JA) 1977-03-15 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 (4 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-10969394-B2 Reagents and methods for analysis of proteins and metabolites targeted by covalent probes PTMS, SRMS, HSP90B1 L3MBTL1 1091/4885TSHR 3733/4885ALOX15 3601/4885
US-11789025-B2 Reagents and methods for analysis of proteins and metabolites targeted by covalent probes PTMS, SRMS, HSP90B1 L3MBTL1 1091/4885TSHR 3733/4885ALOX15 3601/4885
US-20210072254-A1 Reagents and Methods for Analysis of Proteins and Metabolites Targeted by Covalent Probes PTMS, SRMS, HSP90B1 L3MBTL1 1091/4885TSHR 3733/4885ALOX15 3601/4885
US-20190346454-A1 Reagents and Methods for Analysis of Proteins and Metabolites Targeted by Covalent Probes PTMS, SRMS, HSP90B1 L3MBTL1 1091/4885TSHR 3733/4885ALOX15 3601/4885

“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.