SCHEMBL8740427

SCHEMBL8740427

c1ccc(OSSOc2ccccn2)nc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 5/20 0.48
▸ LMNA P02545 3/20 0.48
▸ CCR1 P32246 2/20 0.48
▸ CCR5 P51681 2/20 0.48
▸ CCR8 P51685 2/20 0.48
▸ CYP1A2 P05177 1/20 0.48
▸ POLB P06746 1/20 0.48
▸ METAP1 P53582 1/20 0.48
▸ BLM P54132 1/20 0.48
▸ HIF1A Q16665 1/20 0.48
▸ DOHH Q9BU89 1/20 0.48
▸ P4HTM Q9NXG6 1/20 0.48
▸ EHMT2 Q96KQ7 1/20 0.42
▸ EHMT1 Q9H9B1 1/20 0.42
▸ APOBEC3G Q9HC16 1/20 0.42
▸ NPC1 O15118 3/20 0.41
▸ L3MBTL1 Q9Y468 3/20 0.41
▸ TP53 P04637 3/20 0.41
▸ TDP1 Q9NUW8 3/20 0.41
▸ ALOX15 P16050 2/20 0.41

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
SCHEMBL27329143 0.81 — —
SCHEMBL29543410 0.76 KDM4E (0.44) KDM4ELMNACCR1CCR5CCR8
SCHEMBL2357651 0.76 KDM4E (0.44) KDM4ELMNACCR1CCR5CCR8
SCHEMBL409030 0.76 KDM4E (0.55) KDM4ELMNACCR1CCR5CCR8
SCHEMBL367648 0.75 KDM4E (0.42) KDM4ELMNACCR1CCR5CCR8
SCHEMBL4728794 0.74 KDM4E (0.52) KDM4ELMNACCR1CCR5CCR8
Phosphine SCHEMBL17979775 0.74 KDM4E (0.53) KDM4ELMNACCR1CCR5CCR8
Hydrochloric Acid SCHEMBL28670387 0.74 KDM4E (0.53) KDM4ELMNACCR1CCR5CCR8
SCHEMBL2537108 0.73 — —
SCHEMBL2356330 0.73 KDM4E (0.41) KDM4ELMNACCR1CCR5CCR8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2014137350-A1 CITRATE SALTS FOR ELIMINATING ODORS MONROE MANUS BERNARD (US) 2014-09-12 — — WO disclosed
EP-0677088-A4 GEL-FREE PAINT CONTAINING CUPROUS OXIDE PLUS 2,2'-DITHIOBIS(PYRIDINE-1-OXIDE) COMPOUND. OLIN CORP (US) 1997-10-08 — — EP disclosed
EP-0677088-A1 GEL-FREE PAINT CONTAINING CUPROUS OXIDE PLUS 2,2'-DITHIOBIS(PYRIDINE-1-OXIDE) COMPOUND OLIN CORPORATION (US) 1995-10-18 — — EP disclosed
WO-1994016024-A1 GEL-FREE PAINT CONTAINING CUPROUS OXIDE PLUS 2,2'-DITHIOBIS(PYRIDINE-1-OXIDE) COMPOUND OLIN CORPORATION (US) 1994-07-21 — — WO disclosed
EP-0130333-A1 Process for oxidizing halopyridines to halopyridine-N-oxides OLIN CORPORATION (US) 1985-01-09 — — EP disclosed
EP-0090177-A1 Process for oxidizing halopyridines to halopyridine-N-oxides OLIN CORPORATION (US) 1983-10-05 — — EP disclosed
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