SCHEMBL3107707

SCHEMBL3107707

C=C(C)COC(C)Oc1ccc(Sc2ccc(OC(C)OCC(=C)C)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.40
LMNA P02545 3/20 0.40
HPGD P15428 2/20 0.39
GAA P10253 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
THRB P10828 1/20 0.37
POLB P06746 1/20 0.33
PTGIR P43119 2/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
GPR174 Q9BXC1 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
SCHEMBL10870364 0.90 POLB (0.38) GAAPOLBL3MBTL1GPR174
SCHEMBL2153398 0.83 MAPT (0.37) LMNAHPGDNPSR1POLBGPR174
SCHEMBL548111 0.82 RAB9A (0.37) SMN1; SMN2HPGDPOLB
SCHEMBL2248368 0.82 POLB (0.40) LMNAGAAPOLB
SCHEMBL9181136 0.81 MTNR1A (0.42) LMNAHPGDGAAGPR174
SCHEMBL59812 0.79 HTT (0.36) SMN1; SMN2HPGDGAAPOLB
SCHEMBL7572469 0.78 SMN1; SMN2 (0.33) SMN1; SMN2LMNAHPGDGAANPSR1
SCHEMBL6655593 0.78 THRB (0.42) THRBPOLB
SCHEMBL6551445 0.78 KMT2A (0.56) POLB
SCHEMBL6552734 0.78 ALDH1A3 (0.53) SMN1; SMN2LMNAHPGDPOLB

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7799844-B2 Active energy beam-curable composition for optical material TOAGOSEI CO., LTD. (JP) 2010-09-21 US disclosed
US-7754781-B2 Active energy beam-curable composition TOAGOSEI CO., LTD. (JP) 2010-07-13 US disclosed
US-20080194727-A1 Active Energy Beam-Curable Composition TOAGOSEI CO., LTD. (JP) 2008-08-14 US disclosed
EP-1857469-A1 ACTIVE ENERGY RAY-CURABLE COMPOSITION TOAGOSEI CO., LTD. (JP) 2007-11-21 EP disclosed
US-20070043143-A1 Active energy beam-curable composition for optical material THOMSON LICENSING (FR) 2007-02-22 US disclosed