SCHEMBL17818648

SCHEMBL17818648

C=COC(CCC)OC(CC)COC(=O)CCC(=O)O

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
CYP3A4 P08684 1/20 0.35
ATM Q13315 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
PRKCA P17252 4/20 0.33
PRKCE Q02156 2/20 0.33
PRKCQ Q04759 2/20 0.33
PRKCD Q05655 2/20 0.33
AKT1 P31749 1/20 0.31
ENPP2 Q13822 4/20 0.31

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
SCHEMBL587060 0.84 ALDH1A1 (0.38) TSHRALDH1A1LMNACYP3A4ATM
SCHEMBL17818649 0.79 ALDH1A1 (0.31) ALDH1A1LMNA
SCHEMBL2193181 0.79 ALDH1A1 (0.37) TSHRALDH1A1LMNATDP1
SCHEMBL1564161 0.77 ALDH1A1 (0.33) TSHRALDH1A1LMNACYP3A4ATM
SCHEMBL6470476 0.76 ALDH1A1 (0.43) TSHRALDH1A1LMNACYP3A4ATM
SCHEMBL2754607 0.75 PRKCA (0.39) ALDH1A1LMNAPRKCAPRKCEPRKCQ
SCHEMBL17987626 0.75 ENPP2 (0.36) TSHRALDH1A1LMNACYP3A4ATM
SCHEMBL586958 0.73 TSHR (0.41) TSHRALDH1A1LMNACYP3A4ATM
SCHEMBL3135233 0.73 ALDH1A1 (0.40) TSHRALDH1A1LMNAPRKCAPRKCE
SCHEMBL15811674 0.72 ENPP2 (0.33) TSHRALDH1A1LMNACYP3A4ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10066108-B2 Composition including fluorine-containing polymer comprising at least one type of group selected from group comprising polymerizable functional groups and cross-linkable functional groups; and coated article DAIKIN INDUSTRIES, LTD. (JP) 2018-09-04 US disclosed
US-20160168389-A1 COMPOSITION INCLUDING FLUORINE-CONTAINING POLYMER COMPRISING AT LEAST ONE TYPE OF GROUP SELECTED FROM GROUP COMPRISING POLYMERIZABLE FUNCTIONAL GROUPS AND CROSS-LINKABLE FUNCTIONAL GROUPS; AND COATED ARTICLE DAIKIN INDUSTRIES, LTD. (JP) 2016-06-16 US disclosed