SCHEMBL7871849

SCHEMBL7871849

C=C(C)C(=O)OOOC(=O)C(=C)C.C=CC(=O)OOOC(=O)C=C

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.41
TSHR P16473 10/20 0.33
HPGD P15428 1/20 0.32
TP53 P04637 3/20 0.32
THRB P10828 1/20 0.31
HIF1A Q16665 2/20 0.31
CYP3A4 P08684 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL17984806 1.00 ALDH1A1 (0.41) ALDH1A1TSHRHPGDTP53THRB
SCHEMBL27843178 0.86 ALDH1A1 (0.44) ALDH1A1TSHRHPGDTP53THRB
SCHEMBL11764875 0.84 THRB (0.52) ALDH1A1TSHRHPGDTP53THRB
SCHEMBL177817 0.83 ALDH1A1 (0.55) ALDH1A1TSHRTHRBHSD17B10
Ethylene SCHEMBL15640205 0.81 ALDH1A1 (0.52) ALDH1A1TSHRTHRBHSD17B10
Methacrylic Acid SCHEMBL3195293 0.81 ALDH1A1 (0.39) ALDH1A1TSHRHPGDTP53THRB
SCHEMBL26479 0.81 TSHR (0.42) ALDH1A1TSHRHPGDTP53THRB
SCHEMBL3507426 0.78 TSHR (0.31) ALDH1A1TSHRTP53HIF1ACYP3A4
SCHEMBL8958346 0.78 TSHR (0.31) ALDH1A1TSHRTP53HIF1ACYP3A4
Bromide SCHEMBL10699735 0.78 TSHR (0.40) ALDH1A1TSHRHPGDTP53HIF1A

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-6333071-B1 SUPPRESSING VIBRATIONS OCCURRING IN DIRECTION PERPENDICULAR TO DIRECTION IN WHICH OPTICAL FIBERS OR OPTICAL FIBER RIBBONS ARE ARRANGED SUMITOMO ELECTRIC INDUSTRIES, LTD. (JP) 2001-12-25 US disclosed