SCHEMBL18164870

SCHEMBL18164870

O=S(=O)(Oc1cc(N(c2ccccc2)c2ccc3sc4ccccc4c3c2)ccc1N(c1cccc(-c2ccccc2)c1)c1ccc2sc3ccccc3c2c1)C(F)(F)F

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PTPN7 P35236 1/20 0.32
▸ DUSP3 P51452 1/20 0.32
▸ PTPN12 Q05209 1/20 0.32
▸ PTPN22 Q9Y2R2 1/20 0.32
▸ STS P08842 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
SCHEMBL18164869 0.90 KEAP1 (0.32) —
SCHEMBL18164824 0.83 PTPN7 (0.33) PTPN7DUSP3PTPN12PTPN22
SCHEMBL18164855 0.83 CA12 (0.34) —
SCHEMBL23871157 0.81 STS (0.32) PTPN7DUSP3PTPN12PTPN22STS
SCHEMBL18164814 0.80 ALDH1A1 (0.33) PTPN7DUSP3PTPN12PTPN22
SCHEMBL17126479 0.80 GPR3 (0.42) PTPN7DUSP3PTPN12PTPN22
SCHEMBL18164783 0.79 LMNA (0.31) PTPN7DUSP3PTPN12PTPN22
SCHEMBL18164810 0.79 — —
SCHEMBL25892564 0.79 GPR3 (0.41) PTPN7DUSP3PTPN12PTPN22
SCHEMBL19801836 0.79 GPR3 (0.41) PTPN7DUSP3PTPN12PTPN22

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-2016167491-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC APPARATUS 덕산네오룩스 주식회사 2016-10-20 — — WO disclosed
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