SCHEMBL11065587

SCHEMBL11065587

Cc1ccc(OC(=O)NCCO)cc1

nearest known ligand 0.69

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.69
MMP13 P45452 1/20 0.59
LMNA P02545 1/20 0.50
MGLL Q99685 6/20 0.49
TAAR1 Q96RJ0 2/20 0.49
NPC1 O15118 2/20 0.49
GAA P10253 1/20 0.49
RAB9A P51151 1/20 0.49

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
SCHEMBL1022182 0.86 MGLL (0.65) SMN1; SMN2MGLL
SCHEMBL13577783 0.86 SMN1; SMN2 (0.69) SMN1; SMN2LMNAMGLLTAAR1NPC1
SCHEMBL25227685 0.86 MGLL (0.56) SMN1; SMN2LMNAMGLLTAAR1NPC1
SCHEMBL4271747 0.84 SMN1; SMN2 (0.50) SMN1; SMN2MMP13LMNAMGLLTAAR1
SCHEMBL25278122 0.83 MGLL (0.68) MGLL
SCHEMBL2243907 0.81 SMN1; SMN2 (0.63) SMN1; SMN2TAAR1NPC1GAARAB9A
SCHEMBL1690926 0.81 KMT2A (0.54) SMN1; SMN2LMNAMGLLGAA
SCHEMBL25276937 0.81 MGLL (0.73) MGLL
SCHEMBL25229300 0.80 MGLL (0.76) MGLL
SCHEMBL27962771 0.80 MGLL (0.76) MGLL

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-4446300-A DIELECTRICS, FORMING TRIS/2-HYDROXYETHYL/ISOCYANURATE IN SITU FROM CYANURIC ACID AND ETHYLENE CARBONATE THE P. D. GEORGE COMPANY (US) 1984-05-01 US disclosed
US-4113706-A Aromatic imino acids and resins derived therefrom THE P. D. GEORGE COMPANY (US) 1978-09-12 US disclosed
US-4069209-A DIELECTRIC COATINGS FOR WIRES THE P. D. GEORGE COMPANY (US) 1978-01-17 US disclosed