SCHEMBL8991265

SCHEMBL8991265

Nc1ccc2nc(SCc3ccccc3)sc2c1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 14/20 0.74
MEN1 O00255 5/20 0.74
KMT2A Q03164 5/20 0.74
RAB9A P51151 3/20 0.74
SMN1; SMN2 Q16637 2/20 0.74
NPC1 O15118 2/20 0.74
NFKB1 P19838 1/20 0.74
NFKB2 Q00653 1/20 0.74
RELA Q04206 1/20 0.74
ALDH1A1 P00352 6/20 0.70
CYP3A4 P08684 2/20 0.59
KEAP1 Q14145 1/20 0.57
TP53 P04637 2/20 0.57
HPGD P15428 2/20 0.56
KDM4E B2RXH2 2/20 0.56
GLA P06280 1/20 0.56
GAA P10253 1/20 0.56
PKM P14618 1/20 0.56
LMNA P02545 4/20 0.56
GFER P55789 1/20 0.52

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
SCHEMBL9357205 0.83 MAPT (0.59) MAPTMEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL8357739 0.83 MAPT (0.62) MAPTMEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL6635501 0.83 MAPT (0.67) MAPTMEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL3077568 0.82 CYP1A2 (0.69) MAPTMEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL617400 0.79 KEAP1 (0.69) MAPTMEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL1060971 0.78 CYP1A2 (0.67) MAPTMEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL8361473 0.78 MAPT (0.80) MAPTMEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL9042870 0.77 MAPT (0.56) MAPTMEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL865987 0.76 KEAP1 (0.74) MAPTMEN1KMT2ARAB9ASMN1; SMN2
Hydrochloric Acid SCHEMBL8991608 0.76 MAPT (0.55) MAPTMEN1KMT2ARAB9ASMN1; SMN2

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