SCHEMBL628000

SCHEMBL628000

OC1CCN(c2nn3cc(I)nc3s2)CC1

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPT P10636 18/20 0.42
GAA P10253 1/20 0.37
LMNA P02545 1/20 0.37
THRB P10828 4/20 0.36
POLB P06746 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35

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
SCHEMBL627773 0.85 MAPT (0.43) MAPTLMNATHRBPOLB
SCHEMBL627055 0.81 MAPT (0.48) MAPTGAALMNATHRBRXFP1
SCHEMBL627226 0.76 CKS1B (0.46) MAPT
SCHEMBL627088 0.75 MAPT (0.32) MAPTTHRB
SCHEMBL626887 0.73 CKS1B (0.48) MAPTTHRB
SCHEMBL627999 0.71 LMNA (0.41) MAPTLMNATHRBRXFP1
SCHEMBL628100 0.71 MAPT (0.54) MAPTGAALMNATHRBPOLB
SCHEMBL628253 0.69 MKNK1 (0.40)
SCHEMBL625621 0.69 MAP3K12 (0.46) MAPT
SCHEMBL22216924 0.64 IDO1 (0.42) MAPTGAALMNAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012020215-A1 AMINO- IMIDAZOLOTHIADIAZOLES FOR USE AS PROTEIN OR LIPID KINASE INHIBITORS CENTRO NACIONAL DE INVESTIGACIONES ONCOLÓGICAS (CNIO) (ES) 2012-02-16 WO disclosed