SCHEMBL10909168

SCHEMBL10909168

C=CCSC(=O)CCC(=O)SCC=C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.38
TRPA1 O75762 3/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
CYP3A4 P08684 2/20 0.38
HPGD P15428 2/20 0.38
ALOX15 P16050 1/20 0.38
ALOX5 P09917 1/20 0.38
MAPT P10636 2/20 0.36
ABCC4 O15439 1/20 0.36
TSHR P16473 1/20 0.36
APP P05067 1/20 0.34
TERT O14746 1/20 0.32
MDM4 O15151 1/20 0.32
TP53 P04637 1/20 0.32
CTSL P07711 1/20 0.32
CTSB P07858 1/20 0.32
SLC25A21 Q9BQT8 1/20 0.32
LMNA P02545 1/20 0.31
KDM4E B2RXH2 1/20 0.30
MITF O75030 1/20 0.30

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
SCHEMBL28912299 0.91 ABCC4 (0.45) ALDH1A1TRPA1CYP3A4HPGDALOX15
SCHEMBL11169744 0.84 CES1 (0.42) ALDH1A1SMN1; SMN2HPGDTSHRTP53
SCHEMBL11500199 0.84 SMN1; SMN2 (0.42) ALDH1A1TRPA1SMN1; SMN2CYP3A4HPGD
SCHEMBL18339131 0.82 TSHR (0.47) ALDH1A1ALOX15TSHRAPP
SCHEMBL1151310 0.81
SCHEMBL12580542 0.80 ALDH1A1 (0.33) ALDH1A1TRPA1SMN1; SMN2CYP3A4HPGD
SCHEMBL3849838 0.80 TSHR (0.50) ALDH1A1SMN1; SMN2ALOX15TSHRAPP
SCHEMBL11177480 0.80 TSHR (0.50) ALDH1A1SMN1; SMN2ALOX15TSHRAPP
SCHEMBL1532458 0.79
SCHEMBL11875920 0.79

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1805728-B Shampoo and body detergent composition TAKASAGO PERFUMERY CO LTD 2010-10-13 CN disclosed
CN-1306107-C Refining liquid for cotton fiber and conbinuous control method for cotton fiber enzyme rifining NEGASE GOSEI CO LTD (JP) 2007-03-21 CN disclosed
CN-1805728-A Shampoo and body detergent composition TAKASAGO PERFUMERY CO LTD (JP) 2006-07-19 CN disclosed
CN-1512003-A Refining liquid for cotton fiber and conbinuous control method for cotton fiber enzyme rifining 长�化成株式会社 2004-07-14 CN disclosed
CN-1318976-A Use of polymers as sticking agents RHODIA CHIMIE SA (FR) 2001-10-24 CN disclosed
CN-1061151-A Cleaning compositions PROCTER & GAMBLE (US) 1992-05-20 CN disclosed
US-4600519-A Process for improving friction modification properties of a power transmission fluid with an alkylthio succinic acid or anhydride EXXON RESEARCH & ENGINEERING CO. (US) 1986-07-15 US disclosed