SCHEMBL8608446

SCHEMBL8608446

C1=CC2C=CC1=C2.CCOC(=O)N1c2ccccc2C=CC1OCC

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.82
LMNA P02545 2/20 0.82
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
P2RX4 Q99571 4/20 0.36
ALDH1A1 P00352 6/20 0.36
MAPK1 P28482 3/20 0.36
TSHR P16473 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
BCHE P06276 1/20 0.35
GAA P10253 1/20 0.35
PTBP1 P26599 1/20 0.33
P2RX1 P51575 1/20 0.33
P2RX3 P56373 1/20 0.33
P2RX7 Q99572 1/20 0.33
MAPT P10636 2/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL367474 0.91 SMN1; SMN2 (1.00) SMN1; SMN2LMNAMEN1KMT2AP2RX4
SCHEMBL29367804 0.91 SMN1; SMN2 (1.00) SMN1; SMN2LMNAMEN1KMT2AP2RX4
SCHEMBL23705539 0.91 SMN1; SMN2 (1.00) SMN1; SMN2LMNAMEN1KMT2AP2RX4
SCHEMBL338 0.91 SMN1; SMN2 (1.00) SMN1; SMN2LMNAMEN1KMT2AP2RX4
Carbimide SCHEMBL10800076 0.86 SMN1; SMN2 (0.90) SMN1; SMN2LMNAMEN1KMT2AP2RX4
1,2-Dichloroethane SCHEMBL28697158 0.86 SMN1; SMN2 (0.90) SMN1; SMN2LMNAMEN1KMT2AP2RX4
SCHEMBL8608444 0.84 SMN1; SMN2 (0.86) SMN1; SMN2LMNAMEN1KMT2AP2RX4
Dimethylformamide SCHEMBL7714545 0.83 SMN1; SMN2 (0.84) SMN1; SMN2LMNAMEN1KMT2AP2RX4
SCHEMBL8063974 0.82 SMN1; SMN2 (0.82) SMN1; SMN2LMNAMEN1KMT2AP2RX4
SCHEMBL9188247 0.82 SMN1; SMN2 (0.82) SMN1; SMN2LMNAMEN1KMT2AP2RX4

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-0830059-A2 CRYOPRESERVATION OF DIVERSE PLANT CELLS PHYTON, INC. (US) 1998-03-25 EP disclosed
WO-1996039812-A2 CRYOPRESERVATION OF DIVERSE PLANT CELLS PHYTON, INC. (US) 1996-12-19 WO disclosed