SCHEMBL31067269

SCHEMBL31067269

O=[N+]([O-])c1cc(F)cc2ncccc12

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.61
▸ MAPT P10636 10/20 0.53
▸ ALDH1A1 P00352 9/20 0.53
▸ MEN1 O00255 8/20 0.53
▸ KMT2A Q03164 8/20 0.53
▸ KDM4E B2RXH2 6/20 0.53
▸ L3MBTL1 Q9Y468 4/20 0.53
▸ IDO1 P14902 2/20 0.53
▸ TDO2 P48775 2/20 0.53
▸ CTSB P07858 2/20 0.53
▸ GAA P10253 2/20 0.53
▸ NCOA1 Q15788 1/20 0.53
▸ NCOA3 Q9Y6Q9 1/20 0.53
▸ LMNA P02545 5/20 0.51
▸ TDP1 Q9NUW8 4/20 0.51
▸ PKM P14618 3/20 0.51
▸ CASP6 P55212 2/20 0.51
▸ CYP1A2 P05177 1/20 0.51
▸ TSHR P16473 1/20 0.51
▸ THRB P10828 1/20 0.51

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
SCHEMBL10844067 0.81 POLB (0.61) POLBMAPTALDH1A1MEN1KMT2A
SCHEMBL27825461 0.80 POLB (0.56) POLBMAPTALDH1A1MEN1KMT2A
SCHEMBL7812084 0.79 MAPT (0.67) POLBMAPTALDH1A1MEN1KMT2A
SCHEMBL31067271 0.79 POLB (0.50) POLBMAPTALDH1A1MEN1KMT2A
SCHEMBL27242758 0.77 MAPT (0.65) POLBMAPTALDH1A1MEN1KMT2A
SCHEMBL30694309 0.77 POLB (0.53) POLBMAPTALDH1A1MEN1KMT2A
SCHEMBL30694287 0.77 POLB (0.53) POLBMAPTALDH1A1MEN1KMT2A
SCHEMBL8544530 0.77 POLB (0.56) POLBMAPTALDH1A1MEN1KMT2A
SCHEMBL29750649 0.76 POLB (1.00) POLBMAPTALDH1A1MEN1KMT2A
SCHEMBL827685 0.76 POLB (1.00) POLBMAPTALDH1A1MEN1KMT2A

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-118496154-A Quinoline group-containing triptycene diamine monomer, polymer and preparation method 吉林大学 2024-08-16 — — CN disclosed
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