SCHEMBL27961981

SCHEMBL27961981

CCCCOCc1ccccc1.[H+]

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.56
L3MBTL1 Q9Y468 3/20 0.56
TDP1 Q9NUW8 2/20 0.56
ALDH1A1 P00352 3/20 0.51
CYP3A4 P08684 1/20 0.51
MAPK1 P28482 1/20 0.51
HPGD P15428 1/20 0.50
LTA4H P09960 2/20 0.47
HRH4 Q9H3N8 1/20 0.46
HRH3 Q9Y5N1 1/20 0.46
CETP P11597 3/20 0.45
NAAA Q02083 1/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL317686 0.98 TSHR (0.58) TSHRL3MBTL1TDP1ALDH1A1CYP3A4
SCHEMBL29098435 0.96 TSHR (0.56) TSHRL3MBTL1TDP1ALDH1A1CYP3A4
Ethylene SCHEMBL27858613 0.94 L3MBTL1 (0.54) TSHRL3MBTL1TDP1ALDH1A1CYP3A4
SCHEMBL30186165 0.94 L3MBTL1 (0.54) TSHRL3MBTL1TDP1ALDH1A1CYP3A4
SCHEMBL26813199 0.94 L3MBTL1 (0.58) TSHRL3MBTL1TDP1ALDH1A1CYP3A4
SCHEMBL30856538 0.94 L3MBTL1 (0.54) TSHRL3MBTL1TDP1ALDH1A1CYP3A4
SCHEMBL30856524 0.94 L3MBTL1 (0.54) TSHRL3MBTL1TDP1ALDH1A1CYP3A4
SCHEMBL3969873 0.94 L3MBTL1 (0.54) TSHRL3MBTL1TDP1ALDH1A1CYP3A4
SCHEMBL3965126 0.94 L3MBTL1 (0.54) TSHRL3MBTL1TDP1ALDH1A1CYP3A4
SCHEMBL941253 0.92 TSHR (0.56) TSHRL3MBTL1TDP1ALDH1A1CYP3A4

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-103897619-A Sealing sheet NITTO DENKO CORP 2014-07-02 CN disclosed
CN-103897618-A Sealing sheet NITTO DENKO CORP 2014-07-02 CN disclosed