SCHEMBL23246436

SCHEMBL23246436

O=S(=O)(O)c1cc2ccc3cccnc3c2nc1S(=O)(=O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 5/20 0.52
▸ MAPT P10636 4/20 0.52
▸ ALDH1A1 P00352 4/20 0.52
▸ HTT P42858 3/20 0.52
▸ TDP1 Q9NUW8 3/20 0.52
▸ LMNA P02545 2/20 0.52
▸ SMN1; SMN2 Q16637 2/20 0.52
▸ L3MBTL1 Q9Y468 1/20 0.52
▸ HIF1A Q16665 3/20 0.48
▸ ALOX15 P16050 3/20 0.48
▸ CCR1 P32246 2/20 0.48
▸ CCR5 P51681 2/20 0.48
▸ CCR8 P51685 2/20 0.48
▸ TSHR P16473 2/20 0.48
▸ GMNN O75496 1/20 0.48
▸ TP53 P04637 1/20 0.48
▸ HSP90AA1 P07900 1/20 0.48
▸ MMP2 P08253 1/20 0.48
▸ CYP3A4 P08684 1/20 0.48
▸ CYP2D6 P10635 1/20 0.48

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
SCHEMBL27923287 0.81 LMNA (0.47) KDM4EMAPTALDH1A1HTTTDP1
SCHEMBL11293508 0.80 LMNA (0.46) KDM4EMAPTALDH1A1HTTTDP1
SCHEMBL687000 0.80 COMT (0.59) KDM4EMAPTALDH1A1HTTTDP1
Phenanthroline SCHEMBL7486962 0.78 KDM4E (0.73) KDM4EMAPTALDH1A1HTTTDP1
Phenanthroline SCHEMBL31562164 0.78 KDM4E (0.73) KDM4EMAPTALDH1A1HTTTDP1
Phenanthroline SCHEMBL1893812 0.78 KDM4E (0.73) KDM4EMAPTALDH1A1HTTTDP1
SCHEMBL17146630 0.78 HIF1A (0.47) KDM4EMAPTALDH1A1HTTTDP1
SCHEMBL17178139 0.78 KDM4E (0.51) KDM4EMAPTALDH1A1HTTTDP1
SCHEMBL30554001 0.78 KDM4E (0.47) KDM4EMAPTALDH1A1HTTTDP1
Water SCHEMBL30286050 0.77 KDM4E (0.46) KDM4EMAPTALDH1A1HTTTDP1

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-110100009-B Method for chemical ligation of nucleic acids 伊鲁米那股份有限公司 2023-11-21 — — CN claimed
CN-115838408-B Calmodulin binding protein MxIQM3 and encoding gene and application thereof 中国农业大学 2024-11-29 — — CN disclosed
WO-2021074275-A1 EFFECTIVE PHOTOMODULATION OF LANTHANIDE (III) ION LUMINESCENCE IN THE VISIBLE OR NEAR-INFRARED RANGE UNIVERSITE DE RENNES 1 (FR) 2021-04-22 — — WO disclosed
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