Sugi Predict

Sugi Predict / Compounds / SCHEMBL23197225

SCHEMBL23197225

SCHEMBL23197225

c1ccc(-c2nc3cc(-c4cccc(N5c6ccccc6C(c6ccccc6)(c6ccccc6)c6ccccc65)c4)ccc3c3c2ccc2oc4ccccc4c23)cc1

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ HPSE Q9Y251 2/20 0.32
▸ KDM4E B2RXH2 2/20 0.31
▸ TP53 P04637 2/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ PKM P14618 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ HSD17B10 Q99714 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
SCHEMBL23196854 0.95 KDM4E (0.31) HPSEKDM4ETP53MEN1ALDH1A1
SCHEMBL23196788 0.94 GAA (0.32) —
SCHEMBL22914106 0.94 KDM4E (0.31) HPSEKDM4ETP53MEN1ALDH1A1
SCHEMBL23197426 0.90 HPSE (0.33) HPSEKDM4ETP53MEN1ALDH1A1
SCHEMBL23197014 0.89 CYP1A2 (0.30) —
SCHEMBL23197033 0.88 PLA2G2A (0.32) —
SCHEMBL23197422 0.88 HPSE (0.34) HPSEKDM4ETP53MEN1ALDH1A1
SCHEMBL22913968 0.87 PRKDC (0.31) KDM4EALDH1A1HPGDKMT2A
SCHEMBL23196901 0.87 TP53 (0.32) KDM4ETP53
SCHEMBL22913353 0.85 TP53 (0.34) KDM4ETP53MEN1ALDH1A1PKM

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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