SCHEMBL3489409

SCHEMBL3489409

Cc1cc(Cl)cc(NC(=O)C2(NC(=O)OC(C)(C)C)CCN(C(=O)OC(C)(C)C)CC2)c1N

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
HDAC2 Q92769 2/20 0.39
HDAC1 Q13547 1/20 0.39
STS P08842 3/20 0.38
ANO1 Q5XXA6 1/20 0.38
GPR119 Q8TDV5 2/20 0.37
FAAH O00519 1/20 0.36
TRPV1 Q8NER1 1/20 0.36
F13A1 P00488 2/20 0.35
TGM2 P21980 2/20 0.35
TGM1 P22735 2/20 0.35
TGM3 Q08188 1/20 0.35
MAPK8 P45983 1/20 0.35
JAK2 O60674 1/20 0.35
JAK1 P23458 1/20 0.35

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
SCHEMBL13403081 0.80 HDAC1 (0.45) HDAC2HDAC1GPR119MAPK8
SCHEMBL3489715 0.76 TSHR (0.44) HDAC1ANO1GPR119MAPK8
SCHEMBL3489648 0.75 HDAC3 (0.42) MEN1KMT2AHDAC2HDAC1GPR119
SCHEMBL1001879 0.73 SMN1; SMN2 (0.57) MEN1KMT2ASTSGPR119
SCHEMBL391708 0.73 USP2 (0.45) MEN1KMT2AGPR119
SCHEMBL3489412 0.72 MEN1 (0.39) MEN1KMT2ASTSANO1JAK2
SCHEMBL392092 0.72 USP2 (0.44) GPR119
SCHEMBL1003450 0.72 USP2 (0.44) GPR119
SCHEMBL4297270 0.70 LIMK2 (0.44) MEN1KMT2AFAAHTRPV1
SCHEMBL1991508 0.69 EPHX1 (0.50)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100093748-A1 SUBSTITUTED PIPERIDINES HAVING PROTEIN KINASE INHIBITING ACTIVITY ASTEX THERAPEUTICS LIMITED (GB) 2010-04-15 US disclosed
EP-2125805-A1 SUBSTITUTED PIPERIDINES HAVING PROTEIN KINASE INHIBITING ACTIVITY Astex Therapeutics Limited (GB) 2009-12-02 EP disclosed
WO-2008075109-A1 SUBSTITUTED PIPERIDINES HAVING PROTEIN KINASE INHIBITING ACTIVITY ASTEX THERAPEUTICS LIMITED (GB) 2008-06-26 WO 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-20100093748-A1 SUBSTITUTED PIPERIDINES HAVING PROTEIN KINASE INHIBITING ACTIVITY PRKAR2B, GRK3, PRKAR2A MEN1 1655/4885KMT2A 1414/4885HDAC2 1392/4885

“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.