SCHEMBL20932149

SCHEMBL20932149

N=C(/C=C\C(=N)c1cccc2ccccc12)c1ccc(-c2ccc3c(c2)Oc2cc4c(cc2O3)C(c2ccccc2)(c2ccccc2)c2ccccc2-4)cc1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL20932465 0.94 PDK2 (0.30) —
SCHEMBL20932655 0.92 MCL1 (0.31) —
SCHEMBL20932154 0.90 MEN1 (0.33) SMN1; SMN2
SCHEMBL20932599 0.87 MEN1 (0.31) SMN1; SMN2
SCHEMBL20932469 0.86 PDK2 (0.34) SMN1; SMN2
SCHEMBL20931989 0.85 MEN1 (0.31) SMN1; SMN2
SCHEMBL20619072 0.83 ALDH1A1 (0.32) ALDH1A1HPGDSMN1; SMN2
SCHEMBL20619245 0.83 ALDH1A1 (0.32) ALDH1A1HPGDSMN1; SMN2
SCHEMBL20932172 0.83 MEN1 (0.35) SMN1; SMN2
SCHEMBL20931616 0.81 KDM4E (0.33) SMN1; SMN2

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-2019078462-A1 NOVEL HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME 주식회사 엘지화학 2019-04-25 — — WO disclosed
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