SCHEMBL41909

SCHEMBL41909

OC(N=C=S)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MIF P14174 5/20 0.57
TSHR P16473 1/20 0.41
LMNA P02545 4/20 0.38
MAPK1 P28482 1/20 0.38
KDM4E B2RXH2 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ADRA2A P08913 1/20 0.35
ADRA2C P18825 1/20 0.35
HIF1A Q16665 1/20 0.35
TRPA1 O75762 1/20 0.35
ALDH1A1 P00352 1/20 0.35
CYP3A4 P08684 1/20 0.35
HPGD P15428 1/20 0.35
CYP2D6 P10635 1/20 0.34
SRC P12931 1/20 0.34

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
SCHEMBL11774527 0.77 LMNA (0.43) MIFTSHRLMNAMAPK1ALDH1A1
SCHEMBL2001199 0.76 MIF (0.61) MIFTSHRHIF1ATRPA1ALDH1A1
SCHEMBL1247431 0.76 MIF (0.61) MIFTSHRHIF1ATRPA1ALDH1A1
SCHEMBL5052780 0.73 MIF (0.57) MIFTSHRHIF1ATRPA1ALDH1A1
1-Phenylethyl Isothiocyanate SCHEMBL3795180 0.73 MIF (1.00) MIFTSHRLMNAKDM4EADRA2A
1-Phenylethyl Isothiocyanate SCHEMBL156959 0.73 MIF (1.00) MIFTSHRLMNAKDM4EADRA2A
1-Phenylethyl Isothiocyanate SCHEMBL3792824 0.73 MIF (1.00) MIFTSHRLMNAKDM4EADRA2A
SCHEMBL14000099 0.73 MIF (0.57) MIFLMNAKDM4EADRA2AADRA2C
1-Phenylethyl Isothiocyanate SCHEMBL27811213 0.73 MIF (1.00) MIFTSHRLMNAKDM4EADRA2A
SCHEMBL27494985 0.73 MIF (0.57) MIFTSHRHIF1ATRPA1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2120611-A1 A LOW FAT CONSUMER PRODUCT COMPRISING A NATURAL PRESERVATIVE SYSTEM AND A METHOD FOR MAKING THE SAME UNILEVER N.V. (NL) 2009-11-25 EP claimed
WO-2008134071-A1 MULTIMODAL ABUSE RESISTANT EXTENDED RELEASE FORMULATIONS THERAQUEST BIOSCIENCES, INC. (US) 2008-11-06 WO claimed
WO-2008098804-A1 A LOW FAT CONSUMER PRODUCT COMPRISING A NATURAL PRESERVATIVE SYSTEM AND A METHOD FOR MAKING THE SAME UNILEVER N.V. (NL) 2008-08-21 WO claimed
WO-2008033351-A2 MULTIMODAL ABUSE RESISTANT AND EXTENDED RELEASE FORMULATIONS THERAQUEST BIOSCIENCES, INC. (US) 2008-03-20 WO claimed
EP-1841320-A2 METHODS AND PHARMACEUTICAL COMPOSITIONS USEFUL FOR TREATING PSORIASIS S.U.L.V.E. Ltd. (IL) 2007-10-10 EP claimed
WO-2006075330-A2 METHODS AND PHARMACEUTICAL COMPOSITIONS USEFUL FOR TREATING PSORIASIS S.U.L.V.E. LTD. (IL) 2006-07-20 WO claimed
US-20230189800-A1 NEMATODE CONTROL UNIVERSITY OF IDAHO (US) 2023-06-22 US disclosed
US-11602147-B2 Nematode control UNIVERSITY OF IDAHO (US) 2023-03-14 US disclosed
US-20220354125-A1 METHOD FOR USING MUSTARD MEAL OR AN EXTRACT THEREOF UNIVERSITY OF IDAHO (US) 2022-11-10 US disclosed
US-11229210-B2 Method for using mustard meal or an extract thereof Univerity of Idaho (US) 2022-01-25 US disclosed
CN-108130192-B Method for extracting high-purity mustard essential oil from mustard seeds 浙江舟山彩麟之食品有限公司 2021-07-06 CN disclosed
US-20200221710-A1 METHOD FOR USING MUSTARD MEAL OR AN EXTRACT THEREOF UNIVERSITY OF IDAHO (US) 2020-07-16 US disclosed
US-20200170246-A1 NEMATODE CONTROL UNIVERSITY OF IDAHO (US) 2020-06-04 US disclosed
EP-1450824-A4 PHARMACEUTICAL COMPOSITION ELAN CORP PLC (IE) 2005-09-28 EP disclosed
WO-2005032283-A1 ISOTHIOCYANATE PRESERVATIVES AND METHODS OF THEIR USE THE PROCTER & GAMBLE COMPANY (US) 2005-04-14 WO disclosed
JP-2005013179-A FERMENTATION CONTROLLING AGENT TAIYO KAGAKU CO LTD 2005-01-20 JP disclosed
EP-1450824-A1 PHARMACEUTICAL COMPOSITION ELAN CORPORATION, Plc (IE) 2004-09-01 EP disclosed
WO-2003039561-A1 PHARMACEUTICAL COMPOSITION ELAN CORPORATION, PLC (IE) 2003-05-15 WO disclosed
EP-1229805-A1 Beverage products comprising a preservative system consisting of an isothiocyanate in combination with a sorbate and/or a benzoate THE PROCTER & GAMBLE COMPANY (US) 2002-08-14 EP disclosed
WO-2001035769-A1 PRODUCTS COMPRISING AN ISOTHIOCYANATE PRESERVATIVE SYSTEM AND METHODS OF THEIR USE THE PROCTER & GAMBLE COMPANY (US) 2001-05-25 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 (6 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-20200221710-A1 METHOD FOR USING MUSTARD MEAL OR AN EXTRACT THEREOF NOTUM, SI, MGAM MIF 616/4885TSHR 4821/4885LMNA 3137/4885
US-20230189800-A1 NEMATODE CONTROL SNCA, NPEPPS, VHL MIF 1360/4885TSHR 4223/4885LMNA 2712/4885
US-20200170246-A1 NEMATODE CONTROL SNCA, NPEPPS, VHL MIF 1360/4885TSHR 4223/4885LMNA 2712/4885
US-11229210-B2 Method for using mustard meal or an extract thereof NOTUM, SI, MGAM MIF 616/4885TSHR 4821/4885LMNA 3137/4885
US-11602147-B2 Nematode control SNCA, NPEPPS, VHL MIF 1360/4885TSHR 4223/4885LMNA 2712/4885
US-20220354125-A1 METHOD FOR USING MUSTARD MEAL OR AN EXTRACT THEREOF NOTUM, SI, MGAM MIF 616/4885TSHR 4821/4885LMNA 3137/4885

“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.