SCHEMBL7997075

SCHEMBL7997075

C=C(C)C(=O)OCCOC(=O)C(C)=CCCCCCCCCCCCC

nearest known ligand 0.65

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.65
THRB P10828 1/20 0.49
EP300 Q09472 1/20 0.42
DGKA P23743 1/20 0.40
CYP2D6 P10635 1/20 0.39
CYP2C19 P33261 1/20 0.39
FAAH O00519 3/20 0.39
POLB P06746 1/20 0.38
APEX1 P27695 1/20 0.38
HTT P42858 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
CCR2 P41597 1/20 0.36
NAAA Q02083 1/20 0.36
ALDH1A1 P00352 1/20 0.35
CES2 O00748 1/20 0.35
HPGD P15428 1/20 0.35

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
SCHEMBL4410571 0.95 TSHR (0.68) TSHRTHRBEP300CYP2D6CYP2C19
SCHEMBL3807932 0.94 TSHR (0.59) TSHRTHRBEP300DGKACYP2D6
SCHEMBL10870250 0.91 TSHR (0.67) TSHRTHRBEP300CYP2D6CYP2C19
SCHEMBL11424882 0.89 TSHR (0.73) TSHRTHRBCYP2D6CYP2C19FAAH
SCHEMBL11329589 0.89 TSHR (0.73) TSHRTHRBCYP2D6CYP2C19FAAH
SCHEMBL7198625 0.89 TSHR (0.73) TSHRTHRBCYP2D6CYP2C19FAAH
Methacrylic Acid SCHEMBL11249803 0.88 TSHR (0.61) TSHREP300CYP2D6CYP2C19FAAH
SCHEMBL8752883 0.87 TSHR (0.58) TSHREP300FAAHHTTNAAA
SCHEMBL9724670 0.87 TSHR (0.58) TSHREP300FAAHHTTNAAA
SCHEMBL19611345 0.87 TSHR (0.49) TSHREP300DGKAFAAHCCR2

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
US-6280799-B1 Viscous substance discharging method using a viscous substance dispenser and pattern forming method using a viscous substance dispenser DAI NIPPON PRINTING CO., LTD. (JP) 2001-08-28 US disclosed
US-4073775-A Powder coating composition ASAHI KASEI KOGYO KABUSHIKI KAISHA (JA) 1978-02-14 US disclosed