SCHEMBL14920529

SCHEMBL14920529

O=C(CS)NC1(NC(=O)CS)CCCCC1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MME P08473 3/20 0.33
CYP2C19 P33261 1/20 0.31
LMNA P02545 1/20 0.30

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
SCHEMBL8701586 0.77 ALDH1A1 (0.35) CYP2C19LMNA
SCHEMBL3949604 0.71 CYP2C19 (0.35) CYP2C19LMNA
SCHEMBL3093771 0.69 EPHX2 (0.54)
SCHEMBL2869814 0.69 EPHX2 (0.54)
SCHEMBL776267 0.69 ALDH1A1 (0.41) CYP2C19LMNA
SCHEMBL24963548 0.65 ATF4 (0.34)
SCHEMBL19276387 0.65 EPHX1 (0.34) LMNA
SCHEMBL9676098 0.65 NPSR1 (0.39)
SCHEMBL11037700 0.64 ALDH1A1 (0.41) LMNA
SCHEMBL7751502 0.64 TSHR (0.38)

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
WO-2013064885-A1 NANOSTRUCTURE BASED METHOD FOR DETECTION AND/OR ISOLATION OF BIOMOLECULE BIGTEC PRIVATE LIMITED (IN) 2013-05-10 WO claimed
WO-2013064885-A1 NANOSTRUCTURE BASED METHOD FOR DETECTION AND/OR ISOLATION OF BIOMOLECULE BIGTEC PRIVATE LIMITED (IN) 2013-05-10 WO disclosed