SCHEMBL8304266

SCHEMBL8304266

O=[N+]([O-])c1ccc(N2CCSC2)c(F)c1

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.62
▸ KMT2A Q03164 2/20 0.62
▸ LMNA P02545 5/20 0.56
▸ MAPT P10636 5/20 0.51
▸ THRB P10828 1/20 0.51
▸ POLB P06746 2/20 0.48
▸ GAA P10253 1/20 0.44
▸ DPP4 P27487 1/20 0.43
▸ SLC6A5 Q9Y345 3/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ SLC6A9 P48067 2/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ HIF1A Q16665 1/20 0.41
▸ TDP1 Q9NUW8 1/20 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
SCHEMBL2151682 0.91 ALDH1A1 (0.69) ALDH1A1KMT2ALMNAMAPTTHRB
SCHEMBL4248193 0.86 ALDH1A1 (0.63) ALDH1A1KMT2ALMNAMAPTTHRB
SCHEMBL14464189 0.83 ALDH1A1 (0.79) ALDH1A1KMT2ALMNAMAPTTHRB
SCHEMBL18396735 0.83 ALDH1A1 (0.66) ALDH1A1KMT2ALMNAMAPTTHRB
SCHEMBL4921368 0.80 ALDH1A1 (0.75) ALDH1A1KMT2ALMNAMAPTTHRB
SCHEMBL30928952 0.79 ALDH1A1 (0.73) ALDH1A1KMT2ALMNAMAPTTHRB
SCHEMBL1127011 0.79 ALDH1A1 (0.73) ALDH1A1KMT2ALMNAMAPTTHRB
SCHEMBL85672 0.79 ALDH1A1 (0.73) ALDH1A1KMT2ALMNAMAPTTHRB
SCHEMBL5058298 0.78 ALDH1A1 (0.71) ALDH1A1KMT2ALMNAMAPTTHRB
SCHEMBL7814507 0.77 ALDH1A1 (0.66) ALDH1A1KMT2ALMNAMAPTTHRB

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
EP-0717738-B1 SUBSTITUTED OXAZINE AND THIAZINE OXAZOLIDINONE ANTIMICROBIALS UPJOHN CO (US) 1999-10-20 — — EP disclosed
US-5880118-A Substituted oxazine and thiazine oxazolidinone antimicrobials PHARMACIA & UPJOHN COMPANY (US) 1999-03-09 — — US disclosed
US-5688792-A BACTERICIDES PHARMACIA & UPJOHN COMPANY (US) 1997-11-18 — — US disclosed
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