SCHEMBL8970195

SCHEMBL8970195

[CH2]C(Cl)C(=O)OCCOC

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.39
ALDH1A1 P00352 1/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.30
HCAR2 Q8TDS4 1/20 0.30

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
SCHEMBL16807253 0.79 TSHR (0.41) TSHRALDH1A1CA12CA1CA2
SCHEMBL10609047 0.79 TSHR (0.45) TSHRALDH1A1CA12CA1CA2
SCHEMBL11212403 0.79 TSHR (0.41) TSHRALDH1A1CA12CA1CA2
SCHEMBL6068321 0.76 TSHR (0.38) TSHRALDH1A1CA12CA1CA2
SCHEMBL8970879 0.76 NAAA (0.52) TSHRALDH1A1CA12CA1CA2
SCHEMBL8970115 0.74
SCHEMBL1269101 0.74 NAAA (0.55) TSHRALDH1A1HCAR2
SCHEMBL8633151 0.73 TSHR (0.43) TSHRALDH1A1CA12CA1CA2
SCHEMBL863124 0.73 TSHR (0.43) TSHRALDH1A1CA12CA1CA2
SCHEMBL7671017 0.73

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-5521145-A Iminothiazoline derivatives and herbicides containing them as active ingredients SUMITOMO CHEMICAL COMPANY, LTD. (JP) 1996-05-28 US disclosed
CN-1113242-A Iminothiazoline derivatives and herbicides containing them as active ingredients SUMITOMO CHEMICAL CO (JP) 1995-12-13 CN disclosed
EP-0683160-A1 Iminothiazoline derivatives and herbicides containing them as active ingredients SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1995-11-22 EP disclosed