SCHEMBL5651303

SCHEMBL5651303

O=C(NN1CCCCC1)c1ccc(-c2nc3c(Cl)cc(C(F)(F)F)cc3[nH]2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CBFB Q13951 1/20 0.47
EGLN1 Q9GZT9 1/20 0.45
CNR1 P21554 5/20 0.43
CNR2 P34972 3/20 0.43
PRSS12 P56730 1/20 0.42
PARP1 P09874 1/20 0.40
HCRTR1 O43613 3/20 0.40
HCRTR2 O43614 3/20 0.40
HTT P42858 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
CHEK2 O96017 2/20 0.39
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
MITF O75030 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
BLM P54132 1/20 0.38

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
SCHEMBL5653369 0.87 CBFB (0.44) CBFBEGLN1CNR1CNR2HCRTR1
SCHEMBL5651448 0.86 CNR1 (0.46) CBFBEGLN1CNR1CNR2HCRTR1
SCHEMBL5649030 0.86 CBFB (0.43) CBFBEGLN1CNR1CNR2HCRTR1
SCHEMBL5652225 0.84 METAP2 (0.43) CBFBEGLN1CNR1CNR2MAPT
SCHEMBL5651481 0.84 DGAT1 (0.57) HDAC6CHEK2DGAT1KCNH2
SCHEMBL5652546 0.82 CNR1 (0.42) CBFBEGLN1CNR1CNR2HTT
SCHEMBL19175774 0.79 DGAT1 (0.52) CBFBEGLN1PARP1HCRTR1HCRTR2
SCHEMBL5650704 0.79 PRSS12 (0.62) PRSS12HDAC6
SCHEMBL19175792 0.78 DGAT1 (0.53) CBFBEGLN1PARP1HCRTR1HCRTR2
SCHEMBL5653630 0.77 PRSS12 (0.54) PRSS12HDAC6CHEK2

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 CBFB 103/4885EGLN1 594/4885CNR1 68/4885

“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.