SCHEMBL9720717

SCHEMBL9720717

Cc1ccc([O])c(C)c1I

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TDP2 O95551 1/20 0.31
NSD2 O96028 1/20 0.31
HSP90AA1 P07900 1/20 0.31
PAX8 Q06710 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
SCHEMBL8917666 0.77 TSHR (0.36) TDP2NSD2HSP90AA1PAX8
SCHEMBL31186207 0.77 TSHR (0.36) TDP2NSD2HSP90AA1PAX8
SCHEMBL187040 0.75 TDP2 (0.40) TDP2NSD2HSP90AA1PAX8
SCHEMBL16970797 0.74 CYP3A4 (0.43)
SCHEMBL7626926 0.73 CYP1A2 (0.39)
SCHEMBL22606956 0.72 POLB (0.48) TDP2NSD2HSP90AA1PAX8
SCHEMBL21624583 0.72 POLB (0.31)
SCHEMBL9720715 0.70
SCHEMBL1936626 0.69 CYP1A2 (0.44)
SCHEMBL6015156 0.69 ALDH1A1 (0.43)

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-5159008-A High viscosity polyphenylene ether, low viscosity polyphenylen ether, polyamide unsaturated polar compound, and mineral filles and-or glass fibers MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1992-10-27 US disclosed
EP-0454156-A2 Thermoplastic resin composition MITSUBISHI CHEMICAL CORPORATION (JP) 1991-10-30 EP disclosed