SCHEMBL1942586

SCHEMBL1942586

CC=C(CCCC(C)CCC=C(C)C)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 3/20 0.49
ALDH1A1 P00352 2/20 0.49
USP2 O75604 1/20 0.48
TSHR P16473 1/20 0.38
PTPN1 P18031 2/20 0.37
KDM4E B2RXH2 1/20 0.36
ATM Q13315 1/20 0.36
FNTA P49354 1/20 0.36
FNTB P49356 1/20 0.36
KDM1A O60341 1/20 0.36
TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL907662 1.00 ALOX15 (0.49) ALOX15ALDH1A1USP2TSHRPTPN1
SCHEMBL6562509 0.83 ALOX15 (0.52) ALOX15ALDH1A1USP2TSHRPTPN1
SCHEMBL30792423 0.83 ALOX15 (0.55) ALOX15ALDH1A1USP2TSHRPTPN1
SCHEMBL585195 0.83 ALOX15 (0.55) ALOX15ALDH1A1USP2TSHRPTPN1
Acetic Acid SCHEMBL30029703 0.81 ALOX15 (0.53) ALOX15ALDH1A1USP2TSHRPTPN1
SCHEMBL1472117 0.81 ALOX15 (0.57) ALOX15ALDH1A1USP2TSHRPTPN1
SCHEMBL9578859 0.81 ALOX15 (0.57) ALOX15ALDH1A1USP2TSHRPTPN1
SCHEMBL2120613 0.81 ALOX15 (0.49) ALOX15ALDH1A1USP2TSHRPTPN1
SCHEMBL11617780 0.81 ALOX15 (0.49) ALOX15ALDH1A1USP2TSHRPTPN1
SCHEMBL11209467 0.80 ALOX15 (0.55) ALOX15ALDH1A1USP2TSHRPTPN1

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-8334252-B2 Perfume-containing hollow body consisting of a polymer matrix SYMRISE AG (DE) 2012-12-18 US disclosed
US-20110130320-A1 PERFUME-CONTAINING HOLLOW BODY CONSISTING OF A POLYMER MATRIX SYMRISE AG (DE) 2011-06-02 US disclosed