SCHEMBL5487927

SCHEMBL5487927

C=CC(=O)OCCCCCCCC(=O)OC(=O)CCCCCCC

nearest known ligand 0.66

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.66
HPGD P15428 1/20 0.66
ALDH1A1 P00352 1/20 0.61
CYP3A4 P08684 1/20 0.61
NAAA Q02083 1/20 0.53
DGKA P23743 1/20 0.53
HCAR2 Q8TDS4 2/20 0.50
PRSS1 P07477 1/20 0.47
PRSS2 P07478 1/20 0.47
PRSS3 P35030 1/20 0.47
MAPT P10636 1/20 0.46
ATM Q13315 1/20 0.46
DNM1 Q05193 1/20 0.45
PAM P19021 2/20 0.45
HTR2C P28335 1/20 0.44

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
SCHEMBL5490063 0.95 TSHR (0.68) TSHRHPGDALDH1A1CYP3A4NAAA
SCHEMBL27887845 0.92 TSHR (0.68) TSHRHPGDALDH1A1CYP3A4NAAA
SCHEMBL10426125 0.92 TSHR (0.68) TSHRHPGDALDH1A1CYP3A4NAAA
SCHEMBL27941343 0.92 TSHR (0.68) TSHRHPGDALDH1A1CYP3A4NAAA
SCHEMBL5487925 0.92 TSHR (0.73) TSHRHPGDALDH1A1CYP3A4NAAA
SCHEMBL28230598 0.90 TSHR (0.66) TSHRHPGDALDH1A1CYP3A4NAAA
SCHEMBL10030735 0.90 DGKA (0.68) TSHRHPGDALDH1A1CYP3A4NAAA
SCHEMBL5490060 0.90 TSHR (0.69) TSHRHPGDALDH1A1CYP3A4NAAA
SCHEMBL13779732 0.89 TSHR (0.73) TSHRHPGDALDH1A1CYP3A4NAAA
SCHEMBL16669730 0.88 TSHR (0.84) TSHRHPGDALDH1A1CYP3A4NAAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070072124-A1 Optical recording composition, production method thereof and optical recording medium FUJI PHOTO FILM CO., LTD. 2007-03-29 US disclosed