SCHEMBL5045895

SCHEMBL5045895

C=COC(COCCO)OC

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPK1 P28482 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 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
SCHEMBL5038315 0.96 MEN1 (0.39) TSHRALDH1A1MAPK1MEN1KMT2A
SCHEMBL7532204 0.96 MEN1 (0.39) TSHRALDH1A1MAPK1MEN1KMT2A
SCHEMBL5046289 0.81 ALDH1A1 (0.40) TSHRALDH1A1MAPK1MEN1KMT2A
SCHEMBL3505033 0.81 TSHR (0.45) TSHRALDH1A1MAPK1MEN1KMT2A
SCHEMBL5045887 0.79 ALDH1A1 (0.38) TSHRALDH1A1MAPK1MEN1KMT2A
SCHEMBL15253826 0.79 TSHR (0.32) TSHR
SCHEMBL30981515 0.78
SCHEMBL5531243 0.77 MEN1 (0.52) TSHRALDH1A1MAPK1MEN1KMT2A
SCHEMBL30380499 0.77 MEN1 (0.52) TSHRALDH1A1MAPK1MEN1KMT2A
SCHEMBL2936139 0.77 MEN1 (0.52) TSHRALDH1A1MAPK1MEN1KMT2A

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
EP-1553113-B1 BIOCOMPATIBLE POLYMER AND FILTER FOR SELECTIVELY ELIMINATING LEUCOCYTES USING THE SAME ASAHI KASEI KURARAY MEDICAL CO (JP) 2008-11-19 EP disclosed
EP-1553113-A1 BIOCOMPATIBLE POLYMER AND FILTER FOR SELECTIVELY ELIMINATING LEUCOCYTES USING THE SAME ASAHI MEDICAL Co., Ltd. (JP) 2005-07-13 EP disclosed