SCHEMBL11085582

SCHEMBL11085582

CCCCNCC1OCCO1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.42
GNAI3 P08754 2/20 0.42
GNAO1 P09471 2/20 0.42
GNAI1 P63096 2/20 0.42
SAT1 P21673 1/20 0.41
ALDH1A1 P00352 1/20 0.39
BCHE P06276 1/20 0.35
ADH1B P00325 1/20 0.33
ADH1C P00326 1/20 0.33
ADH1A P07327 1/20 0.33
ADH7 P40394 1/20 0.33
EPHX1 P07099 1/20 0.33
HTT P42858 1/20 0.33
SLC6A2 P23975 1/20 0.33
FUCA1 P04066 1/20 0.32
GAA P10253 1/20 0.32

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
SCHEMBL11090933 0.92 GNAI3 (0.51) TSHRGNAI3GNAO1GNAI1SAT1
SCHEMBL11084528 0.86 POLB (0.35) GNAI3GNAO1GNAI1SAT1BCHE
SCHEMBL10863163 0.77 CA12 (0.41) GNAI3GNAO1GNAI1SAT1ALDH1A1
SCHEMBL11084808 0.77
SCHEMBL6901082 0.76
SCHEMBL1678483 0.75
SCHEMBL4293789 0.75
SCHEMBL15090923 0.74 GNAI3 (0.46) TSHRGNAI3GNAO1GNAI1SAT1
Hydrochloric Acid SCHEMBL7433088 0.73 SAT1 (0.65) TSHRGNAI3GNAO1GNAI1SAT1
SCHEMBL11185595 0.72 TSHR (0.37) TSHRGNAI3GNAO1GNAI1SAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4478634-A HERBICIDES VELSICOL CHEMICAL CORPORATION (US) 1984-10-23 US disclosed
US-4402729-A HERBICIDES VELSICOL CHEMICAL CORPORATION (US) 1983-09-06 US disclosed
US-4113464-A HERBICIDES VELSICOL CHEMICAL COMPANY (US) 1978-09-12 US disclosed