SCHEMBL4344494

SCHEMBL4344494

C=C(C)C(=O)OC(C(C)O)N(CCO)CCO

nearest known ligand 0.38

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.38
ALDH1A1 P00352 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
SCHEMBL6058432 0.85 TSHR (0.37) TSHRALDH1A1
SCHEMBL6058731 0.83 TSHR (0.40) TSHRALDH1A1
SCHEMBL3949350 0.77 TSHR (0.39) TSHRALDH1A1
SCHEMBL4344492 0.75 ALDH1A1 (0.41) TSHRALDH1A1
SCHEMBL9706994 0.75 TSHR (0.39) TSHRALDH1A1
SCHEMBL13834166 0.74 TSHR (0.41) TSHRALDH1A1
SCHEMBL28270749 0.73 TSHR (0.38) TSHRALDH1A1
Alcohol SCHEMBL27759500 0.72 TSHR (0.47) TSHRALDH1A1
SCHEMBL890775 0.72 TSHR (0.45) TSHRALDH1A1
Ethylene Glycol SCHEMBL26980978 0.70 TSHR (0.48) TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1473310-B1 LEUKOCYTE REMOVAL FILTER COMPRISING A POLYMER COATING ASAHI KASEI MEDICAL CO LTD (JP) 2009-03-18 EP disclosed
EP-1016426-B1 LEUKOCYTE-REMOVING FILTER MATERIAL ASAHI KASEI MEDICAL CO LTD (JP) 2006-05-24 EP disclosed
US-6352642-B1 Leukocyte-removing filter material ASAHI MEDICAL CO., LTD. (JP) 2002-03-05 US disclosed
EP-1016426-A1 LEUKOCYTE-REMOVING FILTER MATERIAL ASAHI MEDICAL Co., Ltd. (JP) 2000-07-05 EP disclosed