SCHEMBL626175

SCHEMBL626175

O=C1CCC(Nc2nn3c(I)cnc3s2)CC1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FYN P06241 15/20 0.46
HASPIN Q8TF76 1/20 0.41
PIM1 P11309 1/20 0.36
MKNK1 Q9BUB5 1/20 0.34
LMNA P02545 1/20 0.30
THRB P10828 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
SCHEMBL628243 0.83 FYN (0.46) FYNHASPINMKNK1
SCHEMBL627199 0.82 FYN (0.46) FYNHASPINMKNK1
SCHEMBL627017 0.80 FYN (0.47) FYNHASPIN
SCHEMBL627849 0.80 FYN (0.46) FYNHASPINPIM1MKNK1
SCHEMBL627167 0.79 FYN (0.46) FYNHASPIN
SCHEMBL627106 0.76 FYN (0.44) FYNHASPIN
SCHEMBL626604 0.74 FYN (0.35) FYNHASPINPIM1
SCHEMBL627111 0.74 LMNA (0.33) LMNATHRB
SCHEMBL625300 0.72 PIK3CA (0.51) FYNHASPIN
SCHEMBL2257059 0.71 MKNK1 (0.63) FYNHASPINPIM1MKNK1

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