SCHEMBL9124169

SCHEMBL9124169

COCCOC(=O)C=CN=C=O

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.37
HCAR2 Q8TDS4 5/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
TSHR P16473 3/20 0.33
ALDH1A1 P00352 2/20 0.31
TP53 P04637 2/20 0.31
HIF1A Q16665 2/20 0.31
MET P08581 1/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL9124143 1.00 ATM (0.37) ATMHCAR2SMN1; SMN2TSHRALDH1A1
SCHEMBL3085589 0.84 HCAR2 (0.53) ATMHCAR2TSHRALDH1A1
SCHEMBL9122826 0.83 TSHR (0.44) ATMHCAR2TSHRALDH1A1TP53
SCHEMBL9122809 0.83 TSHR (0.44) ATMHCAR2TSHRALDH1A1TP53
SCHEMBL9122990 0.79 HCAR2 (0.50) ATMHCAR2TSHRALDH1A1HSD17B10
SCHEMBL3962443 0.79 HCAR2 (0.50) ATMHCAR2TSHRALDH1A1HSD17B10
SCHEMBL9120592 0.79 ATM (0.51) ATMHCAR2TSHRALDH1A1TP53
SCHEMBL9120573 0.79 ATM (0.51) ATMHCAR2TSHRALDH1A1TP53
SCHEMBL9123902 0.78 HCAR2 (0.58) ATMHCAR2SMN1; SMN2TSHR
SCHEMBL9123894 0.78 HCAR2 (0.58) ATMHCAR2SMN1; SMN2TSHR

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
US-5347044-A Trans-beta-isocyanatoacrylate esters, their preparation, and polymers made therefrom CURATORS OF THE UNIVERSITY OF MISSOURI (US) 1994-09-13 US claimed
US-5401819-A Trans-beta-isocyanatoacrylate esters, their preparation, and polymers made therefrom CURATORS OF THE UNIVERSITY OF MISSOURI (US) 1995-03-28 US disclosed
US-5347044-A Trans-beta-isocyanatoacrylate esters, their preparation, and polymers made therefrom CURATORS OF THE UNIVERSITY OF MISSOURI (US) 1994-09-13 US disclosed