SCHEMBL9906106

SCHEMBL9906106

C=CC(=O)NC(C)(C)CS(C)(=O)=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
TSHR P16473 2/20 0.38
MAPK1 P28482 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
TGM2 P21980 1/20 0.35
ZDHHC20 Q5W0Z9 1/20 0.32
ZDHHC2 Q9UIJ5 1/20 0.32
APAF1 O14727 1/20 0.30
POLB P06746 1/20 0.30
GRK2 P25098 1/20 0.30
DNMT1 P26358 1/20 0.30
PTPN7 P35236 1/20 0.30
RECQL P46063 1/20 0.30
BLM P54132 1/20 0.30
PPP1CA P62136 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
SCHEMBL1577089 0.85 ALDH1A1 (0.45) ALDH1A1CYP3A4CYP2C9CYP2C19MEN1
SCHEMBL28723020 0.85 ALDH1A1 (0.47) ALDH1A1CYP3A4CYP2C9CYP2C19MEN1
SCHEMBL19490 0.85 ALDH1A1 (0.47) ALDH1A1CYP3A4CYP2C9CYP2C19MEN1
SCHEMBL12139392 0.83 ALDH1A1 (0.46) ALDH1A1CYP3A4CYP2C9CYP2C19MEN1
SCHEMBL121582 0.83 ALDH1A1 (0.46) ALDH1A1CYP3A4CYP2C9CYP2C19MEN1
SCHEMBL12002785 0.83 ALDH1A1 (0.46) ALDH1A1CYP3A4CYP2C9CYP2C19MEN1
SCHEMBL8185123 0.83 ALDH1A1 (0.50) ALDH1A1CYP3A4CYP2C9CYP2C19MEN1
Water SCHEMBL10732835 0.83 ALDH1A1 (0.46) ALDH1A1CYP3A4CYP2C9CYP2C19MEN1
Iodide SCHEMBL7702886 0.83 ALDH1A1 (0.46) ALDH1A1CYP3A4CYP2C9CYP2C19MEN1
SCHEMBL3166879 0.83 ALDH1A1 (0.46) ALDH1A1CYP3A4CYP2C9CYP2C19MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11807701-B2 Biofouling resistant coatings and methods of making and using the same THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-11-07 US disclosed
US-20230246229-A1 ORGANIC SULFONATE ELECTROLYTE ADDITIVES FOR ZINC BATTERIES Octet Scientific, Inc. 2023-08-03 US disclosed
US-20230233743-A1 BIOFOULING RESISTANT COATINGS AND METHODS OF MAKING AND USING THE SAME SILQ TECHNOLOGIES CORPORATION 2023-07-27 US disclosed
US-20170334778-A1 GYPSUM SLURRIES WITH LINEAR POLYCARBOXYLATE DISPERSANTS UNITED STATES GYPSUM COMPANY 2017-11-23 US disclosed
US-8546463-B2 Dental adhesive composition DENTSPLY INTERNATIONAL INC. (US) 2013-10-01 US disclosed
US-8198388-B2 One-part self-etching, self-priming dental adhesive composition DENTSPLY INTERNATIONAL INC. (US) 2012-06-12 US disclosed
WO-2008033650-A2 THERMAL INSULATION COMPOSITION BAKER HUGHES INCORPORATED (US) 2008-03-20 WO disclosed
WO-2007092150-A2 HIGH TEMPERATURE FILTRATION CONTROL USING WATER BASED DRILLING FLUID SYSTEMS COMPRISING WATER SOLUBLE POLYMERS BAKER HUGHES INCORPORATED (US) 2007-08-16 WO 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-20230233743-A1 BIOFOULING RESISTANT COATINGS AND METHODS OF MAKING AND USING THE SAME SLC11A2, FHIT, MB ALDH1A1 3284/4885CYP3A4 2848/4885CYP2C9 1128/4885

“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.