SCHEMBL2117712

SCHEMBL2117712

CCCCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCC)(CCCCCCCCCCCCCCCCCC)C(CCCCCCCCCCCCCC)(CCCCCCCCCCCCCC)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.44
LPAR1 Q92633 1/20 0.44
LPAR3 Q9UBY5 1/20 0.44
GPR84 Q9NQS5 7/20 0.43
PPARG P37231 7/20 0.43
PPARD Q03181 7/20 0.43
PPARA Q07869 7/20 0.43
HDAC11 Q96DB2 5/20 0.43
TSHR P16473 4/20 0.43
PTPN1 P18031 3/20 0.43
ALDH1A1 P00352 2/20 0.43
TLR2 O60603 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
FABP4 P15090 2/20 0.43
SLC22A6 Q4U2R8 1/20 0.43
SLC22A8 Q8TCC7 1/20 0.43
MEN1 O00255 1/20 0.43
ESR1 P03372 1/20 0.43
ALOX15 P16050 1/20 0.43
PDE4A P27815 1/20 0.43

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
SCHEMBL924245 1.00 CES2 (0.44) CES2LPAR1LPAR3GPR84PPARG
SCHEMBL993403 1.00 CES2 (0.44) CES2LPAR1LPAR3GPR84PPARG
SCHEMBL4584710 1.00 CES2 (0.44) CES2LPAR1LPAR3GPR84PPARG
SCHEMBL1061636 1.00 CES2 (0.44) CES2LPAR1LPAR3GPR84PPARG
SCHEMBL1127820 1.00 CES2 (0.44) CES2LPAR1LPAR3GPR84PPARG
SCHEMBL5665394 1.00 CES2 (0.44) CES2LPAR1LPAR3GPR84PPARG
SCHEMBL2119178 1.00 CES2 (0.44) CES2LPAR1LPAR3GPR84PPARG
SCHEMBL28421147 0.98 CES2 (0.42) CES2LPAR1LPAR3GPR84PPARG
SCHEMBL28279462 0.98 CES2 (0.42) CES2LPAR1LPAR3GPR84PPARG
Ammonia Solution, Strong SCHEMBL28638428 0.96 CES2 (0.41) CES2LPAR1LPAR3GPR84PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2187859-A1 POLYAMIDE AND EMOLLIENT COMPOSITIONS, PRODUCTS MADE THEREFROM, AND METHODS OF MAKING AND USING SUCH COMPOSITIONS AND PRODUCTS Arizona Chemical Company (US) 2010-05-26 EP claimed
WO-2009039158-A1 POLYAMIDE AND EMOLLIENT COMPOSITIONS, PRODUCTS MADE THEREFROM, AND METHODS OF MAKING AND USING SUCH COMPOSITIONS AND PRODUCTS ARIZONA CHEMICAL COMPANY (US) 2009-03-26 WO claimed
US-20090074685-A1 POLYAMIDE AND EMOLLIENT COMPOSITIONS, PRODUCTS MADE THEREFROM, AND METHODS OF MAKING AND USING SUCH COMPOSITIONS AND PRODUCTS ARIZONA CHEMICAL COMPANY, LLC 2009-03-19 US claimed
US-20120093896-A1 USE OF NANODISPERSIONS TO PROTECT WATER-SOLUBLE INGREDIENTS IN COSMETIC END FORMULATIONS CIBA CORPORATION (US) 2012-04-19 US disclosed
CN-101801331-A Polyamide and cosmetic composition, by the product of said composition preparation, and preparation and use the method for said composition and product ARIZONA CHEM 2010-08-11 CN disclosed
EP-2187859-A1 POLYAMIDE AND EMOLLIENT COMPOSITIONS, PRODUCTS MADE THEREFROM, AND METHODS OF MAKING AND USING SUCH COMPOSITIONS AND PRODUCTS Arizona Chemical Company (US) 2010-05-26 EP disclosed
US-20100111884-A1 UV ABSORBER FORMULATIONS CIBA CORPORATION (US) 2010-05-06 US disclosed
EP-2170250-A1 USE OF NANODISPERSIONS TO PROTECT WATER-SOLUBLE INGREDIENTS IN COSMETIC END FORMULATIONS BASF SE (DE) 2010-04-07 EP disclosed
EP-2099530-A1 UV ABSORBER FORMULATIONS Ciba Holding Inc. (CH) 2009-09-16 EP disclosed
US-20090196894-A1 Self Tanning Composition CIBA CORP. 2009-08-06 US disclosed
WO-2009039158-A1 POLYAMIDE AND EMOLLIENT COMPOSITIONS, PRODUCTS MADE THEREFROM, AND METHODS OF MAKING AND USING SUCH COMPOSITIONS AND PRODUCTS ARIZONA CHEMICAL COMPANY (US) 2009-03-26 WO disclosed
US-20090074685-A1 POLYAMIDE AND EMOLLIENT COMPOSITIONS, PRODUCTS MADE THEREFROM, AND METHODS OF MAKING AND USING SUCH COMPOSITIONS AND PRODUCTS ARIZONA CHEMICAL COMPANY, LLC 2009-03-19 US disclosed
EP-2026746-A2 SELF TANNING COMPOSITION Ciba Holding Inc. (CH) 2009-02-25 EP disclosed
WO-2009016064-A1 USE OF NANODISPERSIONS TO PROTECT WATER-SOLUBLE INGREDIENTS IN COSMETIC END FORMULATIONS BASF SE (CH) 2009-02-05 WO disclosed
WO-2008080892-A1 UV ABSORBER FORMULATIONS CIBA HOLDING INC. (CH) 2008-07-10 WO disclosed
WO-2007137958-A2 SELF TANNING COMPOSITION CIBA HOLDING INC. (CH) 2007-12-06 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 (3 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-20100111884-A1 UV ABSORBER FORMULATIONS C1R, C1S, C9 CES2 889/4885LPAR1 3396/4885LPAR3 3145/4885
US-20090196894-A1 Self Tanning Composition C9, KRT18, F12 CES2 2834/4885LPAR1 2942/4885LPAR3 1458/4885
US-20120093896-A1 USE OF NANODISPERSIONS TO PROTECT WATER-SOLUBLE INGREDIENTS IN COSMETIC END FORMULATIONS CUTA, PROC, RBP1 CES2 1439/4885LPAR1 3555/4885LPAR3 3631/4885

“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.