SCHEMBL19258784

SCHEMBL19258784

C=CCOC(=O)NCCOC(=O)C=C

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.47
ALDH1A1 P00352 4/20 0.47
TP53 P04637 3/20 0.47
HIF1A Q16665 3/20 0.47
CYP3A4 P08684 3/20 0.47
HSD17B10 Q99714 1/20 0.47
HPGD P15428 1/20 0.43
MAPT P10636 1/20 0.39
CACNA1B Q00975 1/20 0.39
APBA1 Q02410 1/20 0.39
THRB P10828 2/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
HRH4 Q9H3N8 2/20 0.35
HRH3 Q9Y5N1 2/20 0.35
ACHE P22303 3/20 0.35
MAPK1 P28482 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ERN1 O75460 2/20 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
SCHEMBL20661643 0.90 TSHR (0.53) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL12111976 0.87 TSHR (0.57) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL13872046 0.87 TSHR (0.57) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL19258785 0.87 TSHR (0.55) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL22166145 0.84 TSHR (0.56) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL19677626 0.84 TSHR (0.53) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL9547223 0.84 MEN1 (0.36) CYP3A4MAPTCACNA1BAPBA1MEN1
SCHEMBL10057620 0.84 TSHR (0.59) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL15871831 0.84 TSHR (0.64) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL22166146 0.83 TSHR (0.50) TSHRALDH1A1TP53HIF1ACYP3A4

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
US-10457841-B2 Allyl acrylate crosslinkers for PSAs 3M INNOVATIVE PROPERTIES COMPANY (US) 2019-10-29 US disclosed
US-20170233617-A1 ALLYL ACRYLATE CROSSLINKERS FOR PSAS 3M INNOVATIVE PROPERTIES COMPANY 2017-08-17 US disclosed