SCHEMBL16624834

SCHEMBL16624834

CC(=O)C[n+]1cscc1C

nearest known ligand 0.40

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
F13A1 P00488 1/20 0.30
TGM1 P22735 1/20 0.30

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
SCHEMBL12401695 0.84 MAPT (0.33)
SCHEMBL21026177 0.82
SCHEMBL21026387 0.79
SCHEMBL21216063 0.69
Bromide SCHEMBL6074195 0.63 MAPT (0.33)
Hydrochloric Acid SCHEMBL6219680 0.63 KMT2A (0.53)
SCHEMBL16624835 0.60
SCHEMBL16624833 0.59 MAPK1 (0.34)
SCHEMBL19036932 0.57 KMT2A (0.38)
Hydrochloric Acid SCHEMBL2953104 0.57 ALDH1A1 (0.50)

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-9622469-B2 Crosslink breakers for preservation of biological substances SPIEGEL DAVID (US) 2017-04-18 US disclosed
EP-3153165-A1 RAPAMYCIN DERIVATIVE, PREPARATION METHOD THEREFOR, AND PHARMACEUTICAL COMPOSITION AND USES THEREOF Institute of Pharmacology and Toxicology Academy of Military Medical Sciences P.L.A. China (CN) 2017-04-12 EP disclosed
US-20160137619-A1 Thiazole Inner Salt Compounds, and Preparation Methods and Uses Thereof INSTITUTE OF PHARMACOLOGY AND TOXICOLOGY ACADEMY OF MILITARY MEDICAL SCIENCES P.L.A. CHINA (CN) 2016-05-19 US disclosed
US-20150099260-A1 Crosslink Breakers for Preservation of Biological Substances SPIEGEL DAVID (US) 2015-04-09 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 (2 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-20150099260-A1 Crosslink Breakers for Preservation of Biological Substances AGER, LMNA, SSB F13A1 141/4885TGM1 2031/4885
US-20160137619-A1 Thiazole Inner Salt Compounds, and Preparation Methods and Uses Thereof PTMS, FURIN, F12 F13A1 603/4885TGM1 1483/4885

“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.