SCHEMBL8928159

SCHEMBL8928159

C=CCNC(=O)OCCO

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ACHE P22303 8/20 0.48
TSHR P16473 3/20 0.48
SMN1; SMN2 Q16637 1/20 0.42
MAPT P10636 1/20 0.42
KMT2A Q03164 1/20 0.39
CHRNB2 P17787 1/20 0.39
CHRNB4 P30926 1/20 0.39
CHRNA3 P32297 1/20 0.39
CHRNA4 P43681 1/20 0.39
ALDH1A1 P00352 1/20 0.35
FAAH O00519 1/20 0.35
PKM P14618 1/20 0.35
RAB9A P51151 1/20 0.34

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
SCHEMBL23111386 0.89 TSHR (0.46) ACHETSHRSMN1; SMN2MAPTKMT2A
SCHEMBL21570876 0.83 TSHR (0.48) ACHETSHRSMN1; SMN2MAPTKMT2A
SCHEMBL13836286 0.83 ACHE (0.50) ACHETSHRSMN1; SMN2MAPTKMT2A
SCHEMBL9641049 0.83
SCHEMBL8865477 0.82 TSHR (0.41) ACHETSHRSMN1; SMN2MAPTKMT2A
SCHEMBL4458944 0.82 ACHE (0.47) ACHETSHRSMN1; SMN2MAPTCHRNB2
SCHEMBL4746818 0.80 SMN1; SMN2 (0.46) TSHRSMN1; SMN2MAPTKMT2AALDH1A1
Hydrochloric Acid SCHEMBL28740453 0.80 TSHR (0.39) ACHETSHRSMN1; SMN2MAPTKMT2A
SCHEMBL12544682 0.79 TSHR (0.38) ACHETSHRSMN1; SMN2MAPTKMT2A
SCHEMBL1486852 0.79 ACHE (0.55) ACHETSHRFAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104380148-B The silicone hydrogel lenses for the barrier ultraviolet light polymerizeing completely 博士伦公司 2018-09-28 CN disclosed
CN-104380148-A Fully polymerized UV blocking silicone hydrogel lens BAUSCH & LOMB 2015-02-25 CN disclosed
CN-100335491-C Macrolide compounds endowed with antiinflammatory activity ZAMBON SPA (IT) 2007-09-05 CN disclosed
EP-0495269-B1 Thermosetting reactive resin mixture, moulded article and coating made therefrom DAINIPPON INK & CHEMICALS (JP) 1997-03-05 EP disclosed
US-5292833-A Polyepoxide compound, carbamate compound and catalyst DAINIPPON INK AND CHEMICALS, INC. (JP) 1994-03-08 US disclosed
WO-1992012192-A2 THERMOSETTING REACTIVE RESIN MIXTURE, MOULDED ARTICLE AND COATING MADE THEREFROM DAINIPPON INK & CHEMICALS, INC. (JP) 1992-07-23 WO disclosed
EP-0495269-A2 Thermosetting reactive resin mixture, moulded article and coating made therefrom DAINIPPON INK AND CHEMICALS, INC. (JP) 1992-07-22 EP disclosed