SCHEMBL20405533

SCHEMBL20405533

N=C(/N=C(\N)c1ccccc1)c1c(-c2ccc(C3(c4ccccc4)c4ccccc4-c4c3ccc3ccccc43)cc2)c2ccccc2c2ccccc12

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ DHFR P00374 1/20 0.30
▸ TYMS P04818 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
SCHEMBL20407067 0.99 — —
SCHEMBL20405009 0.87 KDM4E (0.30) —
SCHEMBL20405181 0.86 DHFR (0.33) DHFRTYMS
SCHEMBL20405513 0.83 KDM4E (0.30) —
SCHEMBL23654272 0.80 PDK2 (0.33) —
SCHEMBL23655106 0.78 — —
SCHEMBL18821318 0.78 MEN1 (0.35) DHFRTYMS
SCHEMBL18821316 0.77 KDM4E (0.35) DHFRTYMS
SCHEMBL20406978 0.75 KDM4E (0.32) DHFRTYMS
SCHEMBL18819287 0.75 AKT1 (0.36) DHFRTYMS

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
EP-3351536-A1 ORGANIC LIGHT-EMITTING DEVICE LG Chem, Ltd. (KR) 2018-07-25 — — EP disclosed
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