SCHEMBL9933436

SCHEMBL9933436

CCCCCCCCCC(CCCCCCC)COC(=O)C(CC)CCCC

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA2 P00918 8/20 0.58
CA1 P00915 4/20 0.58
TSHR P16473 3/20 0.51
CYP3A4 P08684 3/20 0.51
ATM Q13315 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
PRSS1 P07477 1/20 0.50
PRSS2 P07478 1/20 0.50
PRSS3 P35030 1/20 0.50
MAPK1 P28482 2/20 0.48
RECQL P46063 1/20 0.47
ALDH1A1 P00352 3/20 0.45
LMNA P02545 3/20 0.42
ZDHHC7 Q9NXF8 1/20 0.42
HSD17B10 Q99714 1/20 0.40

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
SCHEMBL3807521 1.00 CA2 (0.58) CA2CA1TSHRCYP3A4ATM
SCHEMBL2904337 1.00 CA2 (0.58) CA2CA1TSHRCYP3A4ATM
SCHEMBL9933922 1.00 CA2 (0.58) CA2CA1TSHRCYP3A4ATM
SCHEMBL3326003 1.00 CA2 (0.58) CA2CA1TSHRCYP3A4ATM
SCHEMBL20767415 1.00 CA2 (0.58) CA2CA1TSHRCYP3A4ATM
SCHEMBL7223059 0.95 CYP3A4 (0.58) CA2CA1TSHRCYP3A4ATM
SCHEMBL9934623 0.95 CA2 (0.56) CA2CA1TSHRCYP3A4ATM
SCHEMBL28900906 0.95 CYP3A4 (0.58) CA2CA1TSHRCYP3A4ATM
SCHEMBL3754117 0.93 CA2 (0.52) CA2CA1TSHRCYP3A4ATM
SCHEMBL3747389 0.93 CA2 (0.52) CA2CA1TSHRCYP3A4ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2550954-B1 VASELINE-LIKE COMPOSITION, AND COSMETIC PREPARATION NISSHIN OILLIO GROUP LTD (JP) 2020-03-04 EP disclosed
EP-2494952-B1 COMPOSITION FOR COSMETICS, COSMETIC, METHOD FOR PRODUCING OIL-IN-WATER EMULSION COSMETIC, AND TWO SEPARATE LAYER-TYPE COSMETIC NISSHIN OILLIO GROUP LTD (JP) 2018-02-28 EP disclosed
US-9028850-B2 Composition for cosmetics, cosmetic, method for producing oil-in-water emulsion cosmetic, and two separate layer-type cosmetic THE NISSHIN OILLIO GROUP, LTD. (JP) 2015-05-12 US disclosed
US-9028848-B2 Composition for cosmetics, cosmetic, method for producing oil-in-water emulsion cosmetic, and two separate layer-type cosmetic THE NISSHIN OILLIO GROUP, LTD. (JP) 2015-05-12 US disclosed
CN-102821743-B Vaseline-like composition and cosmetic THE NISSHIN OILLIO GROUP LTD. (JP) 2014-10-29 CN disclosed
US-20130303634-A1 COMPOSITION FOR COSMETICS, COSMETIC, METHOD FOR PRODUCING OIL-IN-WATER EMULSION COSMETIC, AND TWO SEPARATE LAYER-TYPE COSMETIC NISSHIN OILLIO GROUP LTD (JP) 2013-11-14 US disclosed
EP-2550954-A1 VASELINE-LIKE COMPOSITION, AND COSMETIC PREPARATION The Nisshin Oillio Group, Ltd. (JP) 2013-01-30 EP disclosed
US-20130005808-A1 VASELINE-LIKE COMPOSITION AND COSMETIC The Nisshin OilliO Group ,Ltd. (JP) 2013-01-03 US disclosed
EP-2494952-A1 COMPOSITION FOR COSMETICS, COSMETIC, METHOD FOR PRODUCING OIL-IN-WATER EMULSION COSMETIC, AND TWO SEPARATE LAYER-TYPE COSMETIC The Nisshin Oillio Group, Ltd. (JP) 2012-09-05 EP disclosed
US-20120156271-A1 COMPOSITION FOR COSMETICS, COSMETIC, METHOD FOR PRODUCING OIL-IN-WATER EMULSION COSMETIC, AND TWO SEPARATE LAYER-TYPE COSMETIC THE NISSHIN OILLIO GROUP, LTD. (JP) 2012-06-21 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 (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-20120156271-A1 COMPOSITION FOR COSMETICS, COSMETIC, METHOD FOR PRODUCING OIL-IN-WATER EMULSION COSMETIC, AND TWO SEPARATE LAYER-TYPE COSMETIC GK, DGKG, MGLL CA2 3614/4885CA1 4716/4885TSHR 2121/4885
US-20130303634-A1 COMPOSITION FOR COSMETICS, COSMETIC, METHOD FOR PRODUCING OIL-IN-WATER EMULSION COSMETIC, AND TWO SEPARATE LAYER-TYPE COSMETIC GK, DGKA, DGKG CA2 2541/4885CA1 4610/4885TSHR 2175/4885

“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.