SCHEMBL209666

SCHEMBL209666

CC(C)(C)OC(=O)N[C@@H]1CN(S(=O)(=O)C(F)(F)F)CC[C@@H]1NC(=O)OCc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RORC P51449 4/20 0.43
PDE4B Q07343 1/20 0.43
CTSL P07711 2/20 0.42
CPB1 P15086 1/20 0.42
CTSB P07858 1/20 0.42
CTSK P43235 1/20 0.42
TGM2 P21980 5/20 0.42
F13A1 P00488 3/20 0.42
TGM1 P22735 3/20 0.42
KMT2A Q03164 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
TACR1 P25103 2/20 0.41
ALDH1A1 P00352 1/20 0.40
GAA P10253 1/20 0.40
SYK P43405 1/20 0.40

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
SCHEMBL207913 0.83 CTSL (0.47) PDE4BCTSLCPB1CTSBCTSK
SCHEMBL209968 0.82 DRD2 (0.50) PDE4BCTSLCPB1CTSBCTSK
SCHEMBL206802 0.81 KMT2A (0.47) PDE4BCTSLCPB1CTSBCTSK
SCHEMBL4263739 0.81 PDE4B (0.49) PDE4BCTSLCPB1CTSBCTSK
SCHEMBL210039 0.81 PDE4B (0.49) PDE4BCTSLCPB1CTSBCTSK
SCHEMBL208375 0.81 CTSL (0.46) PDE4BCTSLCPB1CTSBCTSK
SCHEMBL4268253 0.81 PDE4B (0.49) PDE4BCTSLCPB1CTSBCTSK
SCHEMBL207775 0.81 PDE4B (0.53) PDE4BCTSLCPB1CTSBCTSK
SCHEMBL3563686 0.79 KMT2A (0.56) PDE4BCTSLCPB1CTSBCTSK
SCHEMBL4033681 0.79 CPB1 (0.54) PDE4BCTSLCPB1CTSBCTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8088796-B2 Triamine derivative DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-01-03 US disclosed
US-8088796-B2 Triamine derivative DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-01-03 US disclosed
US-20090239857-A1 TRIAMINE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-09-24 US disclosed
US-20090239857-A1 TRIAMINE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-09-24 US disclosed
EP-1864982-A1 TRIAMINE DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-12-12 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090239857-A1 TRIAMINE DERIVATIVE F2, F12, F3 RORC 4088/4885PDE4B 3937/4885CTSL 2606/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.