SCHEMBL28756013

SCHEMBL28756013

C=CCCCCCCCCCCCCCCCCCCNC=C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.46
MAPT P10636 2/20 0.39
ABCC4 O15439 1/20 0.39
ALDH1A1 P00352 4/20 0.39
LMNA P02545 3/20 0.39
TRPA1 O75762 2/20 0.37
LPAR3 Q9UBY5 2/20 0.34
LPAR2 Q9HBW0 1/20 0.34
EPHX1 P07099 1/20 0.32
ADH1B P00325 1/20 0.32
ADH1C P00326 1/20 0.32
ADH1A P07327 1/20 0.32
ADH4 P08319 1/20 0.32
ADH7 P40394 1/20 0.32
USP2 O75604 2/20 0.31
TDP1 Q9NUW8 2/20 0.31
HPGD P15428 1/20 0.31
CYP3A4 P08684 1/20 0.31
RECQL P46063 1/20 0.31
SMN1; SMN2 Q16637 1/20 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
SCHEMBL25750315 1.00 TSHR (0.46) TSHRMAPTABCC4ALDH1A1LMNA
SCHEMBL20969492 0.83 ADH1B (0.36) EPHX1ADH1BADH1CADH1AADH4
SCHEMBL2285775 0.82 ADH1B (0.52) TSHRMAPTABCC4ALDH1A1LMNA
SCHEMBL21099797 0.82 TSHR (0.44) TSHREPHX1ADH1BADH1CADH1A
SCHEMBL2283532 0.82 ADH1B (0.52) TSHRMAPTABCC4ALDH1A1LMNA
SCHEMBL2288282 0.82 ADH1B (0.52) TSHRMAPTABCC4ALDH1A1LMNA
SCHEMBL2285298 0.82 ADH1B (0.52) TSHRMAPTABCC4ALDH1A1LMNA
SCHEMBL2282753 0.82 ADH1B (0.52) TSHRMAPTABCC4ALDH1A1LMNA
SCHEMBL2281691 0.82 ADH1B (0.52) TSHRMAPTABCC4ALDH1A1LMNA
SCHEMBL2285935 0.79

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-1814680-B Fluorescent colourant compositions, colouring process and coloured articles DAINICHISEIKA COLOR & CHEMICALS MANUFACTURING CO., LTD. (JP) 2011-12-21 CN disclosed
CN-1814680-A Fluorescent colourant compositions, colouring process and coloured articles DAINICHISEIKA COLOR CHEM (JP) 2006-08-09 CN disclosed