SCHEMBL7559149

SCHEMBL7559149

COC(=O)N(CC#N)c1ccccn1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.44
TSHR P16473 2/20 0.44
ALOX15 P16050 1/20 0.44
HTT P42858 1/20 0.44
POLB P06746 2/20 0.44
TP53 P04637 2/20 0.42
GAA P10253 1/20 0.41
THRB P10828 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
TRPM8 Q7Z2W7 1/20 0.40
HSD17B10 Q99714 1/20 0.40

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
SCHEMBL18378463 0.82 TSHR (0.48) SMN1; SMN2TSHRALOX15HTTPOLB
SCHEMBL7522860 0.77 HSD17B10 (0.47) SMN1; SMN2TSHRALOX15TP53MEN1
SCHEMBL6028292 0.75 POLB (0.42) SMN1; SMN2TSHRPOLBGAATHRB
SCHEMBL20484557 0.75 HTT (0.49) SMN1; SMN2TSHRALOX15HTTPOLB
SCHEMBL761922 0.73 ALOX15 (0.45) SMN1; SMN2TSHRALOX15HTTPOLB
SCHEMBL20546526 0.72 POLB (0.45) SMN1; SMN2TSHRPOLBTP53GAA
SCHEMBL19892686 0.70 L3MBTL1 (0.40) SMN1; SMN2TSHRPOLBGAAMEN1
SCHEMBL7503707 0.69 POLB (0.48) SMN1; SMN2TSHRALOX15HTTPOLB
SCHEMBL18186741 0.69 POLB (0.47) SMN1; SMN2TSHRALOX15HTTPOLB
SCHEMBL28343287 0.69 GAA (0.49) SMN1; SMN2TSHRPOLBTP53GAA

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-0816342-B1 Process for producing 1-substituted-hydantoins SUMITOMO CHEMICAL CO (JP) 2002-02-27 EP disclosed
US-5883260-A Process for producing 1-substituted-hydantoins SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-03-16 US disclosed
EP-0816342-A2 Process for producing 1-substituted-hydantoins SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-01-07 EP disclosed