SCHEMBL1040128

SCHEMBL1040128

CC(=O)OCCSSCCO

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.43
CHRM5 P08912 2/20 0.41
CHRM1 P11229 2/20 0.41
CHRM3 P20309 2/20 0.41
PGR P06401 1/20 0.41
CHRM2 P08172 1/20 0.41
CHRM4 P08173 1/20 0.41
HTR1A P08908 1/20 0.41
CHRNB2 P17787 1/20 0.41
TBXA2R P21731 1/20 0.41
CHRNB4 P30926 1/20 0.41
CHRNA3 P32297 1/20 0.41
CHRNA7 P36544 1/20 0.41
CHRNA4 P43681 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CHRNA10 Q9GZZ6 1/20 0.41
CHRNA9 Q9UGM1 1/20 0.41
TSHR P16473 1/20 0.41
GALR3 O60755 2/20 0.41
GAA P10253 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
SCHEMBL17253261 0.91 ALDH1A1 (0.50) ALDH1A1CHRM5CHRM1CHRM3PGR
SCHEMBL4343290 0.86 ALDH1A1 (0.43) ALDH1A1CHRM5CHRM1CHRM3PGR
SCHEMBL12109957 0.82 ALDH1A1 (0.54) ALDH1A1CHRM5CHRM1CHRM3PGR
SCHEMBL8521561 0.82 TDP1 (0.46) ALDH1A1CHRM5CHRM1CHRM3PGR
SCHEMBL16327847 0.82 ALDH1A1 (0.48) ALDH1A1CHRM5CHRM1CHRM3PGR
SCHEMBL12103657 0.82 ALDH1A1 (0.43) ALDH1A1CHRM5CHRM1CHRM3PGR
SCHEMBL12103912 0.80 ALDH1A1 (0.41) ALDH1A1CHRM5CHRM1CHRM3PGR
SCHEMBL16665531 0.80 TSHR (0.43) ALDH1A1CHRM5CHRM1CHRM3PGR
SCHEMBL16256310 0.80 TSHR (0.56) ALDH1A1CHRM5CHRM1CHRM3PGR
SCHEMBL7112528 0.79

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2075011-A2 Prodrugs Containing Bio-Cleavable Linkers Piramal Life Sciences Limited (IN) 2009-07-01 EP claimed
US-12077557-B2 Puromycin-based probes and methods of use thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2024-09-03 US disclosed
US-20210061842-A1 PUROMYCIN-BASED PROBES AND METHODS OF USE THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2021-03-04 US disclosed
EP-2560634-A1 NITRIC OXIDE RELEASING PRODRUGS OF THERAPEUTIC AGENTS Piramal Enterprises Limited (IN) 2013-02-27 EP disclosed
US-8357723-B2 Prodrugs containing novel bio-cleavable linkers Piramal Enterprises Limited and Apparao Satyam (IN) 2013-01-22 US disclosed
US-8357723-B2 Prodrugs containing novel bio-cleavable linkers Piramal Enterprises Limited and Apparao Satyam (IN) 2013-01-22 US disclosed
US-8357723-B2 Prodrugs containing novel bio-cleavable linkers Piramal Enterprises Limited and Apparao Satyam (IN) 2013-01-22 US disclosed
US-8354455-B2 Prodrugs containing novel bio-cleavable linkers Piramal Enterprises Limited and Apparao Satyam (IN) 2013-01-15 US disclosed
US-8354455-B2 Prodrugs containing novel bio-cleavable linkers Piramal Enterprises Limited and Apparao Satyam (IN) 2013-01-15 US disclosed
US-8354455-B2 Prodrugs containing novel bio-cleavable linkers Piramal Enterprises Limited and Apparao Satyam (IN) 2013-01-15 US disclosed
EP-2266623-A2 Prodrugs containing novel bio-cleavable linkers Piramal Life Sciences Limited (IN) 2010-12-29 EP disclosed
EP-2266623-A2 Prodrugs containing novel bio-cleavable linkers Piramal Life Sciences Limited (IN) 2010-12-29 EP disclosed
EP-1789091-B1 PRODRUGS CONTAINING NOVEL BIO-CLEAVABLE LINKERS PIRAMAL LIFE SCIENCES LTD (IN) 2010-08-25 EP disclosed
EP-1789091-B1 PRODRUGS CONTAINING NOVEL BIO-CLEAVABLE LINKERS PIRAMAL LIFE SCIENCES LTD (IN) 2010-08-25 EP disclosed
EP-2075011-A2 Prodrugs Containing Bio-Cleavable Linkers Piramal Life Sciences Limited (IN) 2009-07-01 EP disclosed
EP-2075011-A2 Prodrugs Containing Bio-Cleavable Linkers Piramal Life Sciences Limited (IN) 2009-07-01 EP disclosed
EP-1789091-A2 PRODRUGS CONTAINING NOVEL BIO-CLEAVABLE LINKERS Nicholas Piramal India Limited (IN) 2007-05-30 EP disclosed
US-20060205674-A2 PRODRUGS CONTAINING NOVEL BIO-CLEAVABLE LINKERS NICHOLAS PIRAMAL INDIA LTD. (IN) 2006-09-14 US disclosed
WO-2006027711-A2 PRODRUGS AND CODRUGS CONTAINING BIO- CLEAVABLE DISULFIDE LINKERS NICHOLAS PIRAMAL INDIA LIMITED (IN) 2006-03-16 WO disclosed
US-20060046967-A1 Prodrugs containing novel bio-cleavable linkers Piramal Enterprises Limited (IN) 2006-03-02 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-12077557-B2 Puromycin-based probes and methods of use thereof NPEPPS, PABPC4, PABPC1 ALDH1A1 4108/4885CHRM5 4715/4885CHRM1 4775/4885
US-20210061842-A1 PUROMYCIN-BASED PROBES AND METHODS OF USE THEREOF NPEPPS, PABPC4, PABPC1 ALDH1A1 4108/4885CHRM5 4715/4885CHRM1 4775/4885
US-20060046967-A1 Prodrugs containing novel bio-cleavable linkers SI, UGT1A1, CYP2B6 ALDH1A1 229/4885CHRM5 3791/4885CHRM1 2438/4885
US-20060205674-A2 PRODRUGS CONTAINING NOVEL BIO-CLEAVABLE LINKERS SI, UGT1A1, PAICS ALDH1A1 220/4885CHRM5 3209/4885CHRM1 2182/4885

“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.