SCHEMBL8991410

SCHEMBL8991410

CCCC(=O)O[C@@H]1OC(=O)N(c2ccc3nc(SCc4ccccc4)sc3c2)C1C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 13/20 0.47
TP53 P04637 3/20 0.47
LMNA P02545 6/20 0.45
ALDH1A1 P00352 2/20 0.43
HPGD P15428 2/20 0.43
ELANE P08246 1/20 0.41
MEN1 O00255 1/20 0.41
NPC1 O15118 1/20 0.41
GAA P10253 1/20 0.41
HTT P42858 1/20 0.41
RAB9A P51151 1/20 0.41
KMT2A Q03164 1/20 0.41
GPR35 Q9HC97 1/20 0.40
GPR55 Q9Y2T6 1/20 0.40
PPM1A P35813 1/20 0.40
PTPN9 P43378 1/20 0.40
DUSP3 P51452 1/20 0.40
PTPN5 P54829 1/20 0.40
PTPN22 Q9Y2R2 1/20 0.40
POLB P06746 1/20 0.39

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
SCHEMBL8991395 0.78 MAPT (0.45) MAPTTP53LMNAALDH1A1HPGD
SCHEMBL8991279 0.70 MAPT (0.50) MAPTTP53LMNAALDH1A1HPGD
SCHEMBL7840655 0.69 MAPT (0.54) MAPTTP53LMNAALDH1A1HPGD
SCHEMBL9045115 0.69 PKM (0.43) MAPTLMNAALDH1A1HPGDMEN1
SCHEMBL8357739 0.65 MAPT (0.62) MAPTTP53LMNAALDH1A1MEN1
SCHEMBL8361473 0.65 MAPT (0.80) MAPTTP53LMNAALDH1A1HPGD
SCHEMBL27462935 0.64 MAPT (0.46) MAPTTP53LMNAALDH1A1HPGD
SCHEMBL8991265 0.63 MAPT (0.74) MAPTTP53LMNAALDH1A1HPGD
SCHEMBL9357205 0.63 MAPT (0.59) MAPTTP53LMNAALDH1A1MEN1
SCHEMBL3077568 0.62 CYP1A2 (0.69) MAPTTP53LMNAALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5529998-A ANTIBACTERIAL MEDICAMENTS BAYER AKTIENGESELLSCHAFT (DE) 1996-06-25 US disclosed
EP-0697412-A1 Benzoxazolyl- and benzo-thiazolyl-oxazolidinones BAYER AG (DE) 1996-02-21 EP disclosed