SCHEMBL28041908

SCHEMBL28041908

CCCCOCCCC.Fc1ccccc1F

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.46
ALDH1A1 P00352 2/20 0.46
L3MBTL1 Q9Y468 3/20 0.46
LTA4H P09960 2/20 0.45
HPGD P15428 1/20 0.45
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
TDP1 Q9NUW8 2/20 0.42
FAAH O00519 3/20 0.42
RARA P10276 1/20 0.42
RARB P10826 1/20 0.42
RECQL P46063 1/20 0.41
NCEH1 Q6PIU2 1/20 0.41
PTGS2 P35354 1/20 0.41

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
SCHEMBL29110929 0.93 L3MBTL1 (0.48) TSHRALDH1A1L3MBTL1LTA4HTDP1
SCHEMBL28291072 0.91 L3MBTL1 (0.47) TSHRALDH1A1L3MBTL1LTA4HTDP1
Biphenyl SCHEMBL15361769 0.79 LTA4H (0.52) TSHRALDH1A1L3MBTL1LTA4HHPGD
O-Xylene SCHEMBL828368 0.79 TSHR (0.48) TSHRALDH1A1L3MBTL1LTA4HHPGD
Fluorobenzene SCHEMBL27538135 0.78 LTA4H (0.48) TSHRALDH1A1LTA4HHPGDRECQL
SCHEMBL255559 0.78 L3MBTL1 (0.72) ALDH1A1L3MBTL1CYP1A2CYP2C9CYP2C19
SCHEMBL23014752 0.78 TAAR1 (0.44) L3MBTL1TDP1
Toluene SCHEMBL349785 0.77 TSHR (0.50) TSHRALDH1A1L3MBTL1LTA4HHPGD
Catechol SCHEMBL1401742 0.77 TSHR (0.50) TSHRALDH1A1L3MBTL1LTA4HHPGD
Anthracene SCHEMBL27904096 0.77 LTA4H (0.50) TSHRALDH1A1L3MBTL1LTA4HHPGD

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
CN-114231293-B Negative dielectric liquid crystal composition and application thereof 重庆汉朗精工科技有限公司 2023-11-10 CN disclosed
CN-105218328-A A kind of dielectric negative liquid crystal compound and preparation method thereof and application JIANGSU HECHENG ADVANCED MATERIALS CO LTD 2016-01-06 CN disclosed