SCHEMBL9010376

SCHEMBL9010376

C=C(C)C(=O)ON=C(C)C

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.48
TDP1 Q9NUW8 2/20 0.41
TSHR P16473 3/20 0.38
THRB P10828 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
HSD17B10 Q99714 1/20 0.32
FAAH O00519 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
SCHEMBL13931313 0.83 SMN1; SMN2 (0.39) ALDH1A1TSHRSMN1; SMN2FAAH
SCHEMBL13682934 0.80 ALDH1A1 (0.44) ALDH1A1TDP1TSHRTHRB
SCHEMBL11678766 0.80 ALDH1A1 (0.44) ALDH1A1TDP1TSHRTHRB
SCHEMBL6307474 0.80 ALDH1A1 (0.44) ALDH1A1TDP1TSHRTHRB
SCHEMBL10773401 0.78 ALDH1A1 (0.42) ALDH1A1TDP1TSHRTHRB
SCHEMBL27349572 0.76
SCHEMBL8430381 0.76
SCHEMBL5013890 0.76
SCHEMBL10871456 0.75 ALDH1A1 (0.39) ALDH1A1TDP1TSHRTHRB
SCHEMBL28214274 0.74

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-0741126-A2 Process for the preparation of oxime methacrylates RÖHM GMBH (DE) 1996-11-06 EP claimed
WO-2013110753-A1 PROCESS FOR THE PREPARATION OF INGENOL-3-ANGELATE LEO PHARMA A/S (DK) 2013-08-01 WO disclosed
US-7592131-B2 Irradiation polymerization of polymethacrylic anhydride; improved positive accuracy; for ink jet recording CANON KABUSHIKI KAISHA (JP) 2009-09-22 US disclosed
EP-0741126-A2 Process for the preparation of oxime methacrylates RÖHM GMBH (DE) 1996-11-06 EP disclosed