SCHEMBL30777263

SCHEMBL30777263

O=C(O)c1c(-n2c3ccccc3c3ccccc32)c(-n2c3ccccc3c3ccccc32)nc(-n2c3ccccc3c3ccccc32)c1-n1c2ccccc2c2ccccc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.47
▸ KDM4E B2RXH2 5/20 0.46
▸ HPGD P15428 2/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ GLA P06280 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ PDE10A Q9Y233 3/20 0.42
▸ AGTR1 P30556 3/20 0.42
▸ POLB P06746 2/20 0.42
▸ ATM Q13315 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ EGFR P00533 1/20 0.41
▸ TSHR P16473 1/20 0.40
▸ DHODH Q02127 2/20 0.38
▸ DUSP3 P51452 1/20 0.38
▸ FABP3 P05413 1/20 0.38
▸ FABP4 P15090 1/20 0.38

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
SCHEMBL30443363 0.86 ALDH1A1 (0.53) ALDH1A1KDM4EHPGDMEN1CYP1A2
SCHEMBL12258327 0.80 KDM4E (0.46) ALDH1A1KDM4ECYP1A2CYP2C19HSD17B10
SCHEMBL21562771 0.76 KDM4E (0.44) ALDH1A1KDM4EHPGDMEN1KMT2A
SCHEMBL23855822 0.75 KDM4E (0.42) ALDH1A1KDM4ECYP1A2CYP2C19POLB
SCHEMBL31037686 0.75 KDM4E (0.42) ALDH1A1KDM4ECYP1A2CYP2C19POLB
SCHEMBL21562747 0.73 KDM4E (0.41) ALDH1A1KDM4EHPGDMEN1KMT2A
SCHEMBL23177382 0.73 KDM4E (0.43) ALDH1A1KDM4EHPGDCYP1A2GLA
SCHEMBL23177403 0.72 ACP1 (0.45) KDM4EMEN1KMT2AHSD17B10POLB
SCHEMBL28702397 0.72 ALDH1A1 (0.68) ALDH1A1KDM4EHPGDHSD17B10POLB
SCHEMBL21462450 0.71 ALDH1A1 (0.43) ALDH1A1KDM4EHPGDMEN1GLA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112778342-B Organic compound, organic light emitting diode and organic light emitting device comprising the same 乐金显示有限公司 2024-08-13 — — CN disclosed
CN-112457200-B Organic compound, organic light emitting diode including the same, and organic light emitting device 乐金显示有限公司 2024-01-09 — — CN disclosed
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