SCHEMBL30370360

SCHEMBL30370360

O=C(c1ccc(N(c2ccccc2)c2ccc3ccccc3c2)cc1)c1ccc(N(c2ccccc2)c2ccc3ccccc3c2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 1/20 0.50
▸ MEN1 O00255 4/20 0.49
▸ KMT2A Q03164 4/20 0.49
▸ HPGD P15428 3/20 0.49
▸ NPC1 O15118 2/20 0.49
▸ RAB9A P51151 2/20 0.49
▸ CES2 O00748 1/20 0.48
▸ CES1 P23141 1/20 0.48
▸ ESR1 P03372 1/20 0.47
▸ ESR2 Q92731 1/20 0.47
▸ HSD17B14 Q9BPX1 1/20 0.45
▸ ALDH1A1 P00352 4/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ TDP1 Q9NUW8 2/20 0.42
▸ ATM Q13315 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ SRD5A2 P31213 1/20 0.42
▸ MAPT P10636 2/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ EGFR P00533 1/20 0.42

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
SCHEMBL12551408 0.90 MEN1 (0.42) ACHEMEN1KMT2AHPGDNPC1
SCHEMBL21765822 0.90 PTGES (0.50) MEN1KMT2AHPGDNPC1RAB9A
SCHEMBL21765570 0.85 PTGES (0.56) CES2CES1ESR1ESR2EGFR
SCHEMBL13720810 0.85 ALDH1A1 (0.50) MEN1KMT2AHPGDALDH1A1TDP1
SCHEMBL23264365 0.85 ALDH1A1 (0.50) MEN1KMT2AHPGDALDH1A1TDP1
SCHEMBL23264340 0.85 ALDH1A1 (0.50) MEN1KMT2AHPGDALDH1A1TDP1
SCHEMBL23264367 0.85 ALDH1A1 (0.50) MEN1KMT2AHPGDALDH1A1TDP1
SCHEMBL13020773 0.85 ALDH1A1 (0.50) MEN1KMT2AHPGDALDH1A1TDP1
SCHEMBL23264547 0.85 ALDH1A1 (0.50) MEN1KMT2AHPGDALDH1A1TDP1
SCHEMBL23264339 0.85 ALDH1A1 (0.50) MEN1KMT2AHPGDALDH1A1TDP1

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
CN-115926782-A Preparation method and application of organic long-afterglow composition 厦门大学 2023-04-07 — — CN claimed
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