SCHEMBL9755161

SCHEMBL9755161

COC(=S)C(Oc1nc(OC)cc(OC)n1)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
EDNRB P24530 14/20 0.47
EDNRA P25101 14/20 0.47
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL9459527 0.83 EDNRB (0.53) EDNRBEDNRAKMT2A
SCHEMBL12096276 0.83 EDNRB (0.53) EDNRBEDNRAKMT2A
SCHEMBL9459285 0.82 EDNRB (0.59) EDNRBEDNRA
SCHEMBL12095204 0.82 EDNRB (0.59) EDNRBEDNRA
SCHEMBL14298981 0.81 EDNRB (0.54) EDNRBEDNRA
SCHEMBL12095220 0.79 EDNRB (0.49) EDNRBEDNRA
SCHEMBL12095364 0.76 PKM (0.54) EDNRBEDNRAKMT2A
SCHEMBL12095212 0.75 EDNRB (0.49) EDNRBEDNRA
SCHEMBL12095354 0.74 EDNRB (0.47) EDNRBEDNRA
SCHEMBL14244959 0.70 EDNRB (0.49) EDNRBEDNRA

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
JP-3193765-A None JP disclosed
JP-H03193765-A ALKANOIC ACID DERIVATIVE AND HERBICIDE KUMIAI CHEM IND CO LTD 1991-08-23 JP disclosed