SCHEMBL9746379

SCHEMBL9746379

CCCCC[Ti](CCCCC)(CCCCC)O[Ti](CCCCC)(CCCCC)CCCCC

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.41
THRB P10828 1/20 0.41
LMNA P02545 3/20 0.35
SLC22A1 O15245 3/20 0.33
SLC22A2 O15244 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
DNM1 Q05193 5/20 0.32
ALDH1A1 P00352 3/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
HSD17B10 Q99714 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
SCHEMBL9745367 0.94 TSHR (0.37) TSHRTHRBLMNASLC22A1SLC22A2
SCHEMBL9745547 0.90 TSHR (0.38) TSHRTHRBLMNAALDH1A1
SCHEMBL9746352 0.87 TSHR (0.32) TSHRTHRB
SCHEMBL9745914 0.85 TSHR (0.33) TSHRTHRBLMNA
SCHEMBL9746862 0.78
SCHEMBL9745441 0.77 TSHR (0.32) TSHRTHRBLMNA
SCHEMBL7596192 0.69 TSHR (0.50) TSHRTHRBLMNASLC22A1SLC22A2
SCHEMBL10774454 0.69 TSHR (0.35) TSHRTHRBLMNA
SCHEMBL15194653 0.67 TSHR (0.57) TSHRTHRBLMNASLC22A1DNM1
SCHEMBL8192107 0.67 TSHR (0.47) TSHRTHRBLMNASLC22A1SLC22A2

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-5100762-A Radiation-sensitive polymer and radiation-sensitive composition containing the same MITSUBISHI DENKI KABUSHIKI KAISHA (JP) 1992-03-31 US disclosed