SCHEMBL28984664

SCHEMBL28984664

O=[N+]([O-])c1ccccc1Oc1nc(Cl)nc(Cl)n1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 2/20 0.61
▸ L3MBTL1 Q9Y468 1/20 0.53
▸ ALDH1A1 P00352 2/20 0.53
▸ HTT P42858 2/20 0.51
▸ TDP1 Q9NUW8 1/20 0.50
▸ GAA P10253 1/20 0.49
▸ NPC1 O15118 2/20 0.49
▸ RAB9A P51151 2/20 0.49
▸ RECQL P46063 1/20 0.49
▸ PIN1 Q13526 7/20 0.48
▸ LMNA P02545 1/20 0.46
▸ ATM Q13315 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ POLB P06746 1/20 0.45
▸ ESR2 Q92731 1/20 0.43

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
SCHEMBL9720999 0.88 HPGD (0.61) HPGDL3MBTL1ALDH1A1HTTTDP1
SCHEMBL39472 0.78 HPGD (0.78) HPGDL3MBTL1ALDH1A1HTTTDP1
SCHEMBL10639500 0.78 HSP90AA1 (0.42) HPGDL3MBTL1ALDH1A1HTTTDP1
SCHEMBL11903189 0.78 ALDH1A1 (0.71) HPGDL3MBTL1ALDH1A1HTTTDP1
SCHEMBL28056476 0.77 L3MBTL1 (0.81) HPGDL3MBTL1ALDH1A1HTTTDP1
SCHEMBL9266291 0.76 HPGD (1.00) HPGDL3MBTL1ALDH1A1HTTTDP1
SCHEMBL28468083 0.75 ALDH1A1 (0.58) HPGDL3MBTL1ALDH1A1HTTTDP1
SCHEMBL3332690 0.75 PIN1 (0.66) HPGDL3MBTL1ALDH1A1HTTGAA
SCHEMBL641831 0.73 HPGD (0.65) HPGDL3MBTL1ALDH1A1HTTTDP1
SCHEMBL14471953 0.73 ALDH1A1 (0.68) HPGDL3MBTL1ALDH1A1HTTTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115785401-A Preparation method and application of nitrogen-rich porous polymer 中国电建集团昆明勘测设计研究院有限公司 2023-03-14 — — CN claimed
CN-115785401-A Preparation method and application of nitrogen-rich porous polymer 中国电建集团昆明勘测设计研究院有限公司 2023-03-14 — — CN disclosed
CN-115785401-A Preparation method and application of nitrogen-rich porous polymer 中国电建集团昆明勘测设计研究院有限公司 2023-03-14 — — CN disclosed
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