SCHEMBL468888

SCHEMBL468888

CC(=O)N[C@@H](Cc1cc(I)c(O)c(I)c1)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIRT5 Q9NXA8 1/20 0.52
FOLH1 Q04609 2/20 0.51
MEN1 O00255 4/20 0.49
KMT2A Q03164 4/20 0.49
THRB P10828 4/20 0.49
LMNA P02545 3/20 0.49
PPARG P37231 3/20 0.49
TTR P02766 2/20 0.49
ADORA3 P0DMS8 2/20 0.49
PDE4D Q08499 2/20 0.49
HSD17B10 Q99714 2/20 0.49
CYP2C9 P11712 2/20 0.49
MAPT P10636 2/20 0.49
ALOX15 P16050 2/20 0.49
PTGS2 P35354 2/20 0.49
THRA P10827 2/20 0.49
ALDH1A1 P00352 2/20 0.49
NR1I2 O75469 2/20 0.49
NR3C1 P04150 1/20 0.49
CYP1A2 P05177 1/20 0.49

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
SCHEMBL468886 1.00 SIRT5 (0.52) SIRT5FOLH1MEN1KMT2ATHRB
SCHEMBL7009395 0.92 THRB (0.50) SIRT5FOLH1MEN1KMT2ATHRB
SCHEMBL3725913 0.90 FOLH1 (0.66) SIRT5FOLH1MEN1KMT2ATHRB
SCHEMBL3725910 0.90 FOLH1 (0.66) SIRT5FOLH1MEN1KMT2ATHRB
SCHEMBL13670914 0.88 GNPAT (0.60) GNPAT
SCHEMBL468892 0.88 THRB (0.69) MEN1KMT2ATHRBLMNAPPARG
SCHEMBL5175793 0.88 GNPAT (0.60) GNPAT
SCHEMBL4875012 0.88 GNPAT (0.60) GNPAT
SCHEMBL468893 0.88 THRB (0.69) MEN1KMT2ATHRBLMNAPPARG
SCHEMBL468853 0.85 FOLH1 (0.70) FOLH1MEN1KMT2ATHRBLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109761830-B Preparation method of levothyroxine sodium 珐玛赫(天津)科技有限公司 2021-12-17 CN claimed
EP-3039068-B1 MOISTURE CURABLE COMPOUND WITH AMINO ACIDS MOMENTIVE PERFORMANCE MAT INC (US) 2020-12-16 EP claimed
US-9914809-B2 Moisture curable composition with amino acids MOMENTIVE PERFORMANCE MATERIALS INC. (US) 2018-03-13 US claimed
US-20160200880-A1 MOISTURE CURABLE COMPOSITION WITH AMINO ACIDS MOMENTIVE PERFORMANCE MATERIALS INC. 2016-07-14 US claimed
EP-3039068-A1 MOISTURE CURABLE COMPOUND WITH AMINO ACIDS Momentive Performance Materials Inc. (US) 2016-07-06 EP claimed
WO-2015031712-A1 MOISTURE CURABLE COMPOUND WITH AMINO ACIDS MOMENTIVE PERFORMANCE MATERIALS INC. (US) 2015-03-05 WO claimed
US-RE44302-E1 N-acetyl aldosamines, N-acetylamino acids and related N-acetyl compounds and their topical use YU RUEY J (US) 2013-06-18 US claimed
US-RE44017-E1 N-acetyl aldosamines, N-acetylamino acids and related N-acetyl compounds and their topical use YU RUEY J (US) 2013-02-19 US claimed
US-RE42902-E1 N-acetyl aldosamines, N-acetylamino acids and related N-acetyl compounds and their topical use TRISTRATA, INC. (US) 2011-11-08 US claimed
US-RE41339-E1 N-acetyl aldosamines, N-acetylamino acids and related N-acetyl compounds and their topical use TRISTRATA, INC. (US) 2010-05-18 US claimed
EP-1639994-A2 Topical composition comprising N-acetylaldosamines or N-acetylamino acids Yu, Ruey J., Dr. (US) 2006-03-29 EP claimed
EP-1570840-A2 TOPICAL COMPOSITION COMPRISING N-ACETYLALDOSAMINES OR N-ACETYLAMINO ACIDS Yu, Ruey J., Dr. (US) 2005-09-07 EP claimed
US-20030054571-A1 Multi-analyte diagnostic test for thyroid disorders BIO-RAD LABORATORIES, INC. (US) 2003-03-20 US claimed
US-6524593-B1 Alleviate or improve various cosmetic conditions and dermatological disorders, skin, hair, nails TRISTRATA, INC. 2003-02-25 US claimed
EP-1272855-A2 MULTI-ANALYTE DIAGNOSTIC TEST FOR THYROID DISORDERS BIO-RAD LABORATORIES, INC. (US) 2003-01-08 EP claimed
WO-2001079844-A2 MULTI-ANALYTE DIAGNOSTIC TEST FOR THYROID DISORDERS BIO-RAD LABORATORIES, INC. (US) 2001-10-25 WO claimed
EP-1143925-A1 TOPICAL COMPOSITION COMPRISING N-ACETYLALDOSAMINES OR N-ACETYLAMINO ACIDS Yu, Ruey J., Dr. (US) 2001-10-17 EP claimed
US-6159485-A COSMETICS; SKIN DISORDERS YUGENIC LIMITED PARTNERSHIP (US) 2000-12-12 US claimed
WO-2000040217-B1 TOPICAL COMPOSITION COMPRISING N-ACETYLALDOSAMINES OR N-ACETYLAMINO ACIDS YUGENIC LIMITED PARTNERSHIP (US) 2000-10-05 WO claimed
WO-2000040217-A1 TOPICAL COMPOSITION COMPRISING N-ACETYLALDOSAMINES OR N-ACETYLAMINO ACIDS YUGENIC LIMITED PARTNERSHIP (US) 2000-07-13 WO claimed