SCHEMBL1040441

SCHEMBL1040441

CCCCCOC(=O)[C@@H](N)CCSC

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NOD1 Q9Y239 4/20 0.47
MARS1 P56192 6/20 0.42
NAAA Q02083 1/20 0.42
EPHX1 P07099 1/20 0.40
TSHR P16473 2/20 0.39
HTR2C P28335 1/20 0.38
METAP2 P50579 1/20 0.38
METAP1 P53582 1/20 0.38

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
SCHEMBL8852379 1.00 NOD1 (0.47) NOD1MARS1NAAAEPHX1TSHR
SCHEMBL2928691 0.98 NOD1 (0.49) NOD1MARS1NAAAEPHX1TSHR
SCHEMBL112341 0.98 NOD1 (0.49) NOD1MARS1NAAAEPHX1TSHR
SCHEMBL8852410 0.98 NOD1 (0.49) NOD1MARS1NAAAEPHX1TSHR
SCHEMBL7780237 0.98 NOD1 (0.49) NOD1MARS1NAAAEPHX1TSHR
SCHEMBL110147 0.98 NOD1 (0.49) NOD1MARS1NAAAEPHX1TSHR
SCHEMBL8852558 0.98 NOD1 (0.49) NOD1MARS1NAAAEPHX1TSHR
SCHEMBL110148 0.98 NOD1 (0.49) NOD1MARS1NAAAEPHX1TSHR
SCHEMBL8852439 0.98 NOD1 (0.49) NOD1MARS1NAAAEPHX1TSHR
SCHEMBL111280 0.98 NOD1 (0.49) NOD1MARS1NAAAEPHX1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116178624-B Isocyanate stabilizer, isocyanate composition and polyurethane resin 万华化学集团股份有限公司 2024-06-25 CN claimed
CN-116178624-A Isocyanate stabilizer, isocyanate composition and polyurethane resin 万华化学集团股份有限公司 2023-05-30 CN claimed
CN-106456633-A Sugar metabolism improving agent 三得利控股株式会社 2017-02-22 CN claimed
CN-106034441-A Method for performing raw soil greening on sulfate-contained sandy soil through soil improvement fertilizer comprising biological agent 山东胜伟园林科技有限公司 2016-10-26 CN claimed
CN-101347877-A Paste-shaped welding combination XIAMEN JISHIYU FUSE SOLDER CO (CN) 2009-01-21 CN claimed
CN-116178624-B Isocyanate stabilizer, isocyanate composition and polyurethane resin 万华化学集团股份有限公司 2024-06-25 CN disclosed
CN-116178624-B Isocyanate stabilizer, isocyanate composition and polyurethane resin 万华化学集团股份有限公司 2024-06-25 CN disclosed
CN-116178624-A Isocyanate stabilizer, isocyanate composition and polyurethane resin 万华化学集团股份有限公司 2023-05-30 CN disclosed
CN-116178624-A Isocyanate stabilizer, isocyanate composition and polyurethane resin 万华化学集团股份有限公司 2023-05-30 CN disclosed
CN-110520195-B Novel nucleoside phosphonate prodrugs 勒芬天主教大学 2023-01-17 CN disclosed
CN-109248633-B Amino acid surfactant and preparation method and application thereof 广州大学 2021-04-02 CN disclosed
CN-109248633-B Amino acid surfactant and preparation method and application thereof 广州大学 2021-04-02 CN disclosed
EP-2001460-A2 COMPOSITIONS FOR PROMOTING HAIR GROWTH Novus International, Inc. (US) 2008-12-17 EP disclosed
US-20080263950-A1 NATURAL OR ARTIFICIAL CULTURE SUPPORTS AND PRESERVATION MEDIA FOR CUT FLOWERS ENRICHED WITH ACTIVE SUBSTANCES MORELLE JEAN 2008-10-30 US disclosed
WO-2007112433-A2 COMPOSITIONS FOR PROMOTING HAIR GROWTH NOVUS INTERNATIONAL INC. (US) 2007-10-04 WO disclosed
US-20070231377-A1 COMPOSITIONS FOR PROMOTING HAIR GROWTH NOVUS INTERNATIONAL INC. (US) 2007-10-04 US disclosed
US-20040139653-A1 Natural or artificial culture supports and preservation media for cut flowers enriched with active substances MORELLE JEAN (FR) 2004-07-22 US disclosed
EP-0758639-A1 Process for preparing isovanillin UBE INDUSTRIES, LTD. (JP) 1997-02-19 EP disclosed
US-4055653-A Sulfur containing trialkoxybenzoylamino carboxylic acids DEUTSCHE GOLD- UND SILBER-SCHEIDEANSTALT VORMALS ROESSLER (DT) 1977-10-25 US disclosed
US-3981910-A Sulfur containing trialkoxybenzoylamino carboxylic acids DEUTSCHE GOLD- UND SILBER-SCHEIDEANSTALT VORMALS ROESSLER (DT) 1976-09-21 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-20070231377-A1 COMPOSITIONS FOR PROMOTING HAIR GROWTH FGF1, MTR, HGF NOD1 4057/4885MARS1 95/4885NAAA 2285/4885

“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.