Thiomorpholine

Thiomorpholine

SCHEMBL9051897

C1CSCCN1.CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCSCC1

nearest known ligand 0.66

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.58
MAPK1 P28482 1/20 0.54
HRH2 P25021 1/20 0.51
HRH1 P35367 1/20 0.51
PABPC1 P11940 1/20 0.51
MMP1 P03956 1/20 0.51
MMP3 P08254 1/20 0.51
ADORA1 P30542 1/20 0.51
CTSS P25774 2/20 0.50
CTSL P07711 1/20 0.50
CTSB P07858 1/20 0.50
CTSK P43235 1/20 0.50
ACE P12821 2/20 0.48
PARP1 P09874 1/20 0.47
AKT1 P31749 1/20 0.47
ATM Q13315 1/20 0.47
P2RX7 Q99572 3/20 0.46

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
SCHEMBL6165855 0.94 KMT2A (0.63) KMT2AMAPK1HRH2HRH1PABPC1
SCHEMBL6165862 0.94 KMT2A (0.63) KMT2AMAPK1HRH2HRH1PABPC1
SCHEMBL29165165 0.90 KMT2A (0.63) KMT2AMAPK1HRH2HRH1PABPC1
SCHEMBL15545933 0.90 KMT2A (0.63) KMT2AMAPK1HRH2HRH1PABPC1
SCHEMBL6163257 0.88 KMT2A (0.59) KMT2AMAPK1HRH2HRH1PABPC1
SCHEMBL6163366 0.88 KMT2A (0.59) KMT2AMAPK1HRH2HRH1PABPC1
SCHEMBL5408063 0.84 KMT2A (0.67) KMT2AMAPK1HRH2HRH1PABPC1
SCHEMBL4900321 0.84 KMT2A (0.67) KMT2AMAPK1HRH2HRH1PABPC1
SCHEMBL6350465 0.83 KMT2A (0.66) KMT2AMAPK1HRH2HRH1PABPC1
SCHEMBL13291363 0.82 KMT2A (0.64) KMT2AMAPK1HRH2HRH1PABPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1996039384-A1 SUBSTITUTED N-(INDOLE-2-CARBONYL)-GLYCINAMIDES AND DERIVATIVES AS GLYCOGEN PHOSPHORYLASE INHIBITORS PFIZER, INC. (US) 1996-12-12 WO disclosed