SCHEMBL5648702

SCHEMBL5648702

CCOc1cc(C(=O)NN2CCCCC2)ccc1-c1nc2ccc(OC)cc2[nH]1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 1/20 0.47
SIRT1 Q96EB6 1/20 0.47
CHEK2 O96017 5/20 0.44
APLNR P35414 2/20 0.43
GFER P55789 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
HDAC6 Q9UBN7 1/20 0.42
PRKAG1 P54619 1/20 0.42
PRKAA1 Q13131 1/20 0.42
PRKAB1 Q9Y478 1/20 0.42
FLT3 P36888 1/20 0.42
MEN1 O00255 1/20 0.42
POLB P06746 1/20 0.42
HTT P42858 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CHEK1 O14757 1/20 0.41
HPSE Q9Y251 1/20 0.41
F9 P00740 1/20 0.41
SLC2A1 P11166 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
SCHEMBL5650806 0.88 SIRT2 (0.46) SIRT2SIRT1CHEK2NPSR1HDAC6
SCHEMBL5649782 0.87 CHEK2 (0.47) SIRT2SIRT1CHEK2APLNRGFER
SCHEMBL5652493 0.86 SIRT2 (0.47) SIRT2SIRT1HDAC6FLT3MEN1
SCHEMBL5648605 0.86 RHEB (0.45) SIRT2SIRT1PRKAG1PRKAA1PRKAB1
SCHEMBL5648451 0.86 CHEK2 (0.46) CHEK2APLNRGFERNPSR1HDAC6
SCHEMBL5651842 0.86 AMY1A (0.54) CHEK2APLNRGFERNPSR1HDAC6
SCHEMBL5650184 0.84 HPSE (0.45) SIRT2SIRT1PRKAG1PRKAA1PRKAB1
SCHEMBL5652578 0.83 SIRT2 (0.42) SIRT2SIRT1PRKAG1PRKAA1PRKAB1
SCHEMBL5650718 0.82 CHEK2 (0.58) SIRT2SIRT1CHEK2MEN1POLB
SCHEMBL5653237 0.81 HDAC6 (0.46) NPSR1HDAC6PRKAG1PRKAA1PRKAB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7220769-B2 Azolylbenzamides and analogues and their use for treating osteoporosis NIKEM RESEARCH S.R.L. (IT) 2007-05-22 US disclosed
US-20050038095-A1 Azolylbenzamides and analogues and their use for treating osteoporosis 3-V BIOSCIENCES, INC. 2005-02-17 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-20050038095-A1 Azolylbenzamides and analogues and their use for treating osteoporosis NR0B2, NR0B1, NCOR1 SIRT2 360/4885SIRT1 300/4885CHEK2 4002/4885

“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.