SCHEMBL15064459

SCHEMBL15064459

CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)NNC(=O)c2ccc(Br)cc2)C1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.57
PKM P14618 1/20 0.57
KMT2A Q03164 3/20 0.52
FPR2 P25090 7/20 0.49
FPR3 P25089 3/20 0.49
IDO1 P14902 2/20 0.48
TDO2 P48775 1/20 0.48
ACKR3 P25106 1/20 0.47
NAMPT P43490 1/20 0.44
USP30 Q70CQ3 1/20 0.44
GPR119 Q8TDV5 1/20 0.43
POLB P06746 1/20 0.43
HDAC1 Q13547 2/20 0.42
HDAC3 O15379 1/20 0.41
HDAC2 Q92769 1/20 0.41
MEN1 O00255 1/20 0.41
CYP2C19 P33261 1/20 0.41
SMN1; SMN2 Q16637 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
SCHEMBL14731327 0.91 KDM4E (0.69) KDM4EPKMKMT2AFPR2FPR3
SCHEMBL12474430 0.90 KDM4E (0.55) KDM4EPKMKMT2AFPR2FPR3
SCHEMBL15064581 0.87 KDM4E (0.49) KDM4EPKMKMT2AFPR2FPR3
SCHEMBL16825871 0.84 KDM4E (0.79) KDM4EPKMKMT2AFPR2FPR3
SCHEMBL12474426 0.84 HDAC3 (0.50) KDM4EPKMHDAC1HDAC3HDAC2
SCHEMBL15064415 0.82 HDAC3 (0.45) KDM4EKMT2ANAMPTPOLBHDAC1
SCHEMBL15145007 0.82 KDM4E (0.61) KDM4EPKMKMT2AFPR2FPR3
SCHEMBL3448188 0.80 KDM4E (0.69) KDM4EPKMKMT2AACKR3NAMPT
SCHEMBL3448190 0.80 KDM4E (0.69) KDM4EPKMKMT2AACKR3NAMPT
SCHEMBL3448200 0.79 KDM4E (0.67) KDM4EPKMKMT2AACKR3GPR119

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
US-20130172384-A1 FATTY ACID SYNTHASE INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED 2013-07-04 US 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-20130172384-A1 FATTY ACID SYNTHASE INHIBITORS FASN, FADS1, FADS2 KDM4E 2066/4885PKM 2131/4885KMT2A 2500/4885

“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.