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SCHEMBL28665114

SCHEMBL28665114

CC(C)(C)c1cc(C2=C3C=CC(=N3)C(c3ccccc3)=C3C=CC(=N3)C(c3cc(C(C)(C)C)cc(C(C)(C)C)c3)=C3C=CC(=N3)C(c3ccccc3)=C3C=CC2=N3)cc(C(C)(C)C)c1.[Cu]

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ RXRB P28702 7/20 0.38
▸ RXRA P19793 6/20 0.38
▸ KIF11 P52732 1/20 0.35
▸ RXRG P48443 4/20 0.34
▸ KDM4E B2RXH2 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ LOXL2 Q9Y4K0 1/20 0.30
▸ S1PR1 P21453 1/20 0.30
▸ S1PR3 Q99500 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
SCHEMBL28670662 0.98 RXRB (0.39) RXRBRXRAKIF11RXRGKDM4E
SCHEMBL2064910 0.89 KDM4E (0.39) RXRBRXRAKIF11RXRGKDM4E
SCHEMBL28689278 0.89 RXRA (0.34) RXRBRXRARXRG
SCHEMBL27979361 0.82 ALDH1A1 (0.35) KDM4EMEN1KMT2A
SCHEMBL1792650 0.80 RXRA (0.32) RXRBRXRAKIF11S1PR1S1PR3
SCHEMBL5015172 0.80 KDM4E (0.33) KDM4EGAAMAPTS1PR1S1PR3
SCHEMBL7996476 0.78 ALDH1A1 (0.35) KDM4EMEN1KMT2A
SCHEMBL14562749 0.78 ALDH1A1 (0.35) KDM4EMEN1KMT2A
SCHEMBL2517442 0.78 ALDH1A1 (0.35) KDM4EMEN1KMT2A
SCHEMBL28807262 0.78 ALDH1A1 (0.35) KDM4EMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113845112-B Porphyrin edge-modified graphene oxide nano hybrid material and preparation and application thereof 同济大学 2023-06-02 — — CN claimed
CN-113845112-A Porphyrin edge modified graphene oxide nano hybrid material and preparation and application thereof 同济大学 2021-12-28 — — CN claimed
CN-113845112-B Porphyrin edge-modified graphene oxide nano hybrid material and preparation and application thereof 同济大学 2023-06-02 — — CN disclosed
CN-113845112-A Porphyrin edge modified graphene oxide nano hybrid material and preparation and application thereof 同济大学 2021-12-28 — — CN disclosed
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