SCHEMBL3068899

SCHEMBL3068899

CC(C)(C)OC(=O)N1CCCN(C(=O)c2ccc(Cl)cc2)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 1.00
MEN1 O00255 4/20 1.00
POLB P06746 2/20 0.57
ABL1 P00519 1/20 0.57
RIN1 Q13671 1/20 0.57
SMN1; SMN2 Q16637 3/20 0.56
HTT P42858 2/20 0.56
ALDH1A1 P00352 2/20 0.56
CNR1 P21554 1/20 0.56
CNR2 P34972 1/20 0.56
CHRNA7 P36544 1/20 0.56
STS P08842 1/20 0.55
NPSR1 Q6W5P4 1/20 0.54
LMNA P02545 2/20 0.52
HDAC4 P56524 1/20 0.52
HSD17B10 Q99714 1/20 0.50
PHGDH O43175 1/20 0.50
EPHX2 P34913 1/20 0.50

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
SCHEMBL1256025 0.96 KMT2A (0.92) KMT2AMEN1POLBABL1RIN1
SCHEMBL3941264 0.86 MEN1 (0.76) KMT2AMEN1POLBABL1RIN1
SCHEMBL8252454 0.84 KMT2A (0.72) KMT2AMEN1POLBABL1RIN1
SCHEMBL3059699 0.84 KMT2A (0.72) KMT2AMEN1POLBABL1RIN1
SCHEMBL3069058 0.84 MEN1 (0.72) KMT2AMEN1ABL1RIN1SMN1; SMN2
SCHEMBL27989783 0.83 MEN1 (0.71) KMT2AMEN1POLBSMN1; SMN2HTT
SCHEMBL29188760 0.82 KMT2A (0.70) KMT2AMEN1POLBABL1RIN1
SCHEMBL5537347 0.82 KMT2A (0.70) KMT2AMEN1POLBABL1RIN1
SCHEMBL3900270 0.82 KMT2A (0.70) KMT2AMEN1POLBABL1RIN1
SCHEMBL1257264 0.82 MEN1 (0.70) KMT2AMEN1SMN1; SMN2HTTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100261708-A1 Diazepane Compounds Which Modulate The CB2 Receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-10-14 US disclosed
US-20100261708-A1 Diazepane Compounds Which Modulate The CB2 Receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-10-14 US disclosed
US-20100261708-A1 Diazepane Compounds Which Modulate The CB2 Receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-10-14 US disclosed
WO-2009055357-A1 DIAZEPANE COMPOUNDS WHICH MODULATE THE CB2 RECEPTOR BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-04-30 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-20100261708-A1 Diazepane Compounds Which Modulate The CB2 Receptor CNR1, CNR2, BDKRB2 KMT2A 2563/4885MEN1 4504/4885POLB 4326/4885

“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.