SCHEMBL3619334

SCHEMBL3619334

CC(=CCC(O)COCCOCC(O)CC=C(C)C(=O)O)C(=O)O

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.35
KDM4E B2RXH2 3/20 0.35
USP2 O75604 2/20 0.35
ALOX15 P16050 1/20 0.35
HSD17B10 Q99714 1/20 0.32
POLB P06746 1/20 0.32
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2C19 P33261 1/20 0.30
CD81 P60033 1/20 0.30
NOS3 P29474 1/20 0.30
NOS1 P29475 1/20 0.30
NOS2 P35228 1/20 0.30
HTT P42858 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL3619332 1.00 ALDH1A1 (0.35) ALDH1A1KDM4EUSP2ALOX15HSD17B10
SCHEMBL1260034 0.89 USP2 (0.49) ALDH1A1KDM4EUSP2ALOX15HSD17B10
SCHEMBL8638825 0.89 USP2 (0.49) ALDH1A1KDM4EUSP2ALOX15HSD17B10
SCHEMBL6250559 0.87 TSHR (0.36) ALDH1A1KDM4EUSP2ALOX15
SCHEMBL6250554 0.87 TSHR (0.36) ALDH1A1KDM4EUSP2ALOX15
SCHEMBL2763358 0.87 MAPT (0.33) ALDH1A1KDM4EUSP2ALOX15CD81
SCHEMBL5050873 0.87 MAPT (0.33) ALDH1A1KDM4EUSP2ALOX15CD81
SCHEMBL4291479 0.86 USP2 (0.53) ALDH1A1KDM4EUSP2ALOX15CYP1A2
SCHEMBL8701577 0.86 CHRNA7 (0.31) ALDH1A1KDM4EUSP2ALOX15
SCHEMBL14717768 0.86 USP2 (0.53) ALDH1A1KDM4EUSP2ALOX15CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3937880-A1 PRIMER AND KIT CONSISTING OF THE PRIMER AND DENTAL MATERIAL Kettenbach GmbH & CO. KG (DE) 2022-01-19 EP claimed
WO-2020182918-A1 PRIMER AND KIT CONSISTING OF THE PRIMER AND DENTAL MATERIAL KETTENBACH GMBH & CO. KG (DE) 2020-09-17 WO claimed
US-7799391-B2 Liquid crystal composition, color filter and liquid crystal display DAI NIPPON PRINTING CO., LTD. (JP) 2010-09-21 US claimed
US-20090195734-A1 Liquid Crystal Composition, Color Filter and Liquid Crystal Display DAI NIPPON PRINTING CO., LTD. (JP) 2009-08-06 US claimed
US-7799391-B2 Liquid crystal composition, color filter and liquid crystal display DAI NIPPON PRINTING CO., LTD. (JP) 2010-09-21 US disclosed
US-20090195734-A1 Liquid Crystal Composition, Color Filter and Liquid Crystal Display DAI NIPPON PRINTING CO., LTD. (JP) 2009-08-06 US disclosed