SCHEMBL18655552

SCHEMBL18655552

CC(=O)OCOC(=O)SCCN

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.34
ALDH1A1 P00352 2/20 0.34
HSD17B10 Q99714 1/20 0.34
MAPT P10636 2/20 0.32
TDP1 Q9NUW8 2/20 0.32
CYP1A2 P05177 1/20 0.32
TSHR P16473 1/20 0.32
NOS1 P29475 1/20 0.32
CYP2C19 P33261 1/20 0.32
CYP3A4 P08684 1/20 0.31
APEX1 P27695 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ACHE P22303 4/20 0.31
IDO1 P14902 1/20 0.31

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
Hydrochloric Acid SCHEMBL18757098 0.98 IDO1 (0.33) LMNAALDH1A1HSD17B10MAPTTDP1
SCHEMBL18655543 0.82 CYP1A2 (0.34) LMNAALDH1A1MAPTTDP1CYP1A2
SCHEMBL18655573 0.82 TDP1 (0.41) LMNAALDH1A1HSD17B10TDP1TSHR
SCHEMBL18655553 0.81 ACHE (0.36) MAPTTDP1CYP1A2TSHRNOS1
Hydrochloric Acid SCHEMBL18757104 0.79 ACHE (0.35) ACHEIDO1
SCHEMBL18655541 0.79 PRKCA (0.33) ALDH1A1
SCHEMBL27982506 0.77
SCHEMBL990499 0.77 ALDH1A1 (0.44) LMNAALDH1A1HSD17B10TSHRSMN1; SMN2
Hydrochloric Acid SCHEMBL17633871 0.75 CYP1A2 (0.42) LMNAALDH1A1HSD17B10MAPTTDP1
SCHEMBL18631675 0.74 ACHE (0.38) ALDH1A1TSHRACHEIDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9630917-B2 Cysteamine prodrugs, pharmaceutical compositions thereof, and methods of use Nguyen, Mark Quang (US) 2017-04-25 US disclosed
US-9630917-B2 Cysteamine prodrugs, pharmaceutical compositions thereof, and methods of use Nguyen, Mark Quang (US) 2017-04-25 US disclosed
US-20170081279-A1 CYSTEAMINE PRODRUGS, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS OF USE Nguyen, Mark Quang (US) 2017-03-23 US disclosed
US-20170081279-A1 CYSTEAMINE PRODRUGS, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS OF USE Nguyen, Mark Quang (US) 2017-03-23 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 (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-20170081279-A1 CYSTEAMINE PRODRUGS, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS OF USE GLS, GLS2, CTH LMNA 2754/4885ALDH1A1 840/4885HSD17B10 643/4885

“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.