SCHEMBL8014309

SCHEMBL8014309

C=CCOC=C(C)C(=O)OCC=C

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.38
CYP3A4 P08684 1/20 0.36
TDP1 Q9NUW8 1/20 0.35
MAPT P10636 2/20 0.34
CACNA1B Q00975 1/20 0.34
APBA1 Q02410 1/20 0.34
PTP4A3 O75365 2/20 0.32
PTP4A1 Q93096 2/20 0.32
PTP4A2 Q12974 1/20 0.32
ALDH1A1 P00352 2/20 0.32
HSD17B10 Q99714 1/20 0.32
MEN1 O00255 1/20 0.30
MAPK1 P28482 1/20 0.30
KMT2A Q03164 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
SCHEMBL11006159 0.89 GLO1 (0.41) TSHRMAPTALDH1A1HSD17B10MEN1
SCHEMBL5152032 0.85 TSHR (0.37) TSHRCYP3A4TDP1MAPTCACNA1B
SCHEMBL6272798 0.81 TSHR (0.49) TSHRALDH1A1
SCHEMBL9241885 0.81 TSHR (0.41) TSHRCYP3A4TDP1MAPTCACNA1B
SCHEMBL45287 0.81 TSHR (0.41) TSHRCYP3A4TDP1MAPTCACNA1B
SCHEMBL524629 0.81 TSHR (0.41) TSHRCYP3A4TDP1MAPTCACNA1B
SCHEMBL4564777 0.80 LMNA (0.33) TSHRCYP3A4TDP1MAPTALDH1A1
SCHEMBL180854 0.80 LMNA (0.36) TSHRCYP3A4MAPTALDH1A1MEN1
SCHEMBL11576487 0.79 MAPT (0.39) TSHRCYP3A4TDP1MAPTCACNA1B
SCHEMBL9501577 0.79 TSHR (0.32) TSHRCYP3A4TDP1ALDH1A1

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
EP-0711780-B1 Process for the preparation of liquid crystalline polyorganosiloxanes containing (meth-)acryloxy groups CONSORTIUM ELEKTROCHEM IND (DE) 2000-01-05 EP disclosed
US-5641850-A HYDROSILATION OF A HYDRIDOPOLYSILOXANE BY AN ALKENE CONTAINING MESOGENIC GROUPS FOLLOWED BY REACTION WITH AN ALKENE CONTAINING A (METH)ACRYLOXY GROUP; CROSSLINKING; HAZE-FREE FILMS CONSORTIUM FUR ELECTROCHEMISCHE INDUSTRIE GMBH (DE) 1997-06-24 US disclosed
EP-0711780-A1 Process for the preparation of liquid crystalline polyorganosiloxanes containing (meth-)acryloxy groups Consortium für elektrochemische Industrie GmbH (DE) 1996-05-15 EP disclosed