SCHEMBL23196872

SCHEMBL23196872

c1ccc(-c2nc3c(-c4cccc(N5c6ccccc6Oc6ccccc65)c4)cccc3c3c2ccc2oc4ccccc4c23)cc1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 2/20 0.34
▸ KDM4E B2RXH2 2/20 0.32
▸ MEN1 O00255 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ PKM P14618 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30
▸ PRKDC P78527 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
SCHEMBL23196871 0.89 TP53 (0.33) TP53KDM4E
SCHEMBL23196900 0.89 TP53 (0.33) TP53KDM4E
SCHEMBL23196901 0.88 TP53 (0.32) TP53KDM4E
SCHEMBL23196845 0.85 PLA2G2A (0.33) TP53KDM4EMEN1ALDH1A1PKM
SCHEMBL23197422 0.85 HPSE (0.34) TP53KDM4EMEN1ALDH1A1PKM
SCHEMBL23197779 0.84 LIMK1 (0.30) —
SCHEMBL22913350 0.83 TP53 (0.36) TP53KDM4EMEN1ALDH1A1PKM
SCHEMBL22914102 0.82 KDM4E (0.33) TP53KDM4EMEN1ALDH1A1PKM
SCHEMBL23197093 0.82 — —
SCHEMBL23197128 0.81 CYP3A4 (0.37) KDM4EMEN1ALDH1A1HPGDKMT2A

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-2021066397-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 엘티소재주식회사 2021-04-08 — — WO disclosed
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