SCHEMBL7600712

SCHEMBL7600712

C=CC(=O)OCC(CCl)P(=O)(O)O

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.48
ALDH1A1 P00352 4/20 0.38
TP53 P04637 3/20 0.38
HIF1A Q16665 3/20 0.38
CYP3A4 P08684 2/20 0.38
HSD17B10 Q99714 1/20 0.38
MAPK1 P28482 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HPGD P15428 1/20 0.35
THRB P10828 2/20 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
SCHEMBL5050815 0.82 TSHR (0.53) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL3278676 0.82 TSHR (0.48) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL5052714 0.77 TSHR (0.60) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL8600908 0.76 TSHR (0.53) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL27522724 0.75 TSHR (0.57) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL15032915 0.74 TSHR (0.52) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL3278845 0.74 TSHR (0.52) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL5059025 0.74 TSHR (0.62) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL1293183 0.73 TSHR (0.55) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL132195 0.73 TSHR (0.55) TSHRALDH1A1TP53HIF1ACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0857583-B1 THERMAL TRANSFER INK RIBBON SONY CHEMICALS CORP (JP) 2002-12-11 EP claimed
US-6099967-A COMPRISING A BASE MATERIAL AND FORMED ON ONE SIDE THEREOF AN INK LAYER COMPRISING A COLORANT AND A BINDER CONTAINING A VINYL CHLORIDE RESIN, WHEREIN THE VINYL CHLORIDE RESIN HAS AT LEAST ONE OF AN EPOXY GROUP AND A STRONG-ACID SALT GROUP SONY CHEMICALS CORPORATION (JP) 2000-08-08 US claimed
EP-0857583-A1 THERMAL TRANSFER INK RIBBON Sony Chemicals Corporation (JP) 1998-08-12 EP claimed
EP-0857583-B1 THERMAL TRANSFER INK RIBBON SONY CHEMICALS CORP (JP) 2002-12-11 EP disclosed
US-6099967-A COMPRISING A BASE MATERIAL AND FORMED ON ONE SIDE THEREOF AN INK LAYER COMPRISING A COLORANT AND A BINDER CONTAINING A VINYL CHLORIDE RESIN, WHEREIN THE VINYL CHLORIDE RESIN HAS AT LEAST ONE OF AN EPOXY GROUP AND A STRONG-ACID SALT GROUP SONY CHEMICALS CORPORATION (JP) 2000-08-08 US disclosed
EP-0857583-A1 THERMAL TRANSFER INK RIBBON Sony Chemicals Corporation (JP) 1998-08-12 EP disclosed