SCHEMBL7744948

SCHEMBL7744948

C=C(C#N)C(=O)OCCCCCCCCCCCCCC

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.62
ALDH1A1 P00352 2/20 0.61
NAAA Q02083 1/20 0.48
RAD52 P43351 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
EPHX1 P07099 1/20 0.46
HCAR2 Q8TDS4 1/20 0.42
FAAH O00519 1/20 0.41
LMNA P02545 1/20 0.41
ACHE P22303 6/20 0.41
DGKA P23743 1/20 0.40
HTR2C P28335 1/20 0.40

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
SCHEMBL8380049 1.00 TSHR (0.62) TSHRALDH1A1NAAARAD52NPSR1
SCHEMBL379519 1.00 TSHR (0.62) TSHRALDH1A1NAAARAD52NPSR1
SCHEMBL15229291 1.00 TSHR (0.62) TSHRALDH1A1NAAARAD52NPSR1
SCHEMBL719001 1.00 TSHR (0.62) TSHRALDH1A1NAAARAD52NPSR1
Ocrylate SCHEMBL29891 1.00 TSHR (0.62) TSHRALDH1A1NAAARAD52NPSR1
SCHEMBL2903638 1.00 TSHR (0.62) TSHRALDH1A1NAAARAD52NPSR1
SCHEMBL29340 1.00 TSHR (0.62) TSHRALDH1A1NAAARAD52NPSR1
SCHEMBL35540 1.00 TSHR (0.62) TSHRALDH1A1NAAARAD52NPSR1
SCHEMBL973728 1.00 TSHR (0.62) TSHRALDH1A1NAAARAD52NPSR1
SCHEMBL3457991 1.00 TSHR (0.62) TSHRALDH1A1NAAARAD52NPSR1

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-6184267-B1 DISCHARGING OILY INK USING ELECTROSTATIC FIELD ON LITHOGRAPHIC PRINTING PLATE PRECURSOR COMPRISING WATER-RESISTANT SUPPORT HAVING IMAGE RECEIVING LAYER HAVING LITHOGRAPHICALLY PRINTABLE HYDROPHILIC SURFACE TO FORM IMAGE FUJI PHOTO FILM CO., LTD. (JP) 2001-02-06 US disclosed