SCHEMBL9265602

SCHEMBL9265602

CC(=O)OC(C#N)OC(C)=O

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.46
CHRM2 P08172 1/20 0.34
CHRM4 P08173 1/20 0.34
CHRM1 P11229 1/20 0.34
TBXA2R P21731 1/20 0.34
ALDH1A1 P00352 2/20 0.33
GALR3 O60755 1/20 0.33
MAPT P10636 1/20 0.33
BLM P54132 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
LMNA P02545 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
ALOX15 P16050 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
SCHEMBL3177084 0.80 TSHR (0.48) TSHRCHRM2CHRM4CHRM1TBXA2R
SCHEMBL16061080 0.78
SCHEMBL28385768 0.78 TSHR (0.46) TSHRCHRM2CHRM4CHRM1TBXA2R
SCHEMBL17224246 0.76
SCHEMBL1235848 0.76
SCHEMBL11326275 0.74
SCHEMBL28015040 0.74 TSHR (0.37) TSHRCHRM2CHRM4CHRM1TBXA2R
SCHEMBL28801076 0.72 TSHR (0.46) TSHRCHRM2CHRM4CHRM1TBXA2R
SCHEMBL7186086 0.72 TSHR (0.46) TSHRCHRM2CHRM4CHRM1TBXA2R
SCHEMBL19395949 0.70

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
EP-0399856-B1 Pteridin-4 (3H)-ones, processes for their preparation and medicaments containing them LIPHA (FR) 1995-08-09 EP disclosed
EP-0399856-A1 Pteridin-4 (3H)-ones, processes for their preparation and medicaments containing them LIPHA, LYONNAISE INDUSTRIELLE PHARMACEUTIQUE (FR) 1990-11-28 EP disclosed