SCHEMBL5481493

SCHEMBL5481493

O=C(NCCCN1CCCCC1)c1cccc(Oc2ccc(Br)cc2)c1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.59
RAF1 P04049 1/20 0.54
SMYD2 Q9NRG4 2/20 0.53
L3MBTL1 Q9Y468 2/20 0.53
MEN1 O00255 1/20 0.53
HPGD P15428 1/20 0.53
KMT2A Q03164 1/20 0.53
TSHR P16473 1/20 0.53
MCHR1 Q99705 2/20 0.52
SCN9A Q15858 1/20 0.52
DRD2 P14416 4/20 0.52
DRD4 P21917 4/20 0.52
MCHR2 Q969V1 1/20 0.52
POLB P06746 1/20 0.50
DRD3 P35462 1/20 0.49
PHF13 Q86YI8 1/20 0.49
L3MBTL3 Q96JM7 1/20 0.49

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
SCHEMBL14430779 0.91 LMNA (0.70) LMNARAF1SMYD2L3MBTL1MEN1
SCHEMBL5481939 0.89 TSHR (0.66) LMNAL3MBTL1TSHRDRD2DRD4
SCHEMBL14430795 0.88 LMNA (0.58) LMNARAF1SMYD2L3MBTL1MEN1
SCHEMBL5481507 0.88 SCN9A (0.68) LMNARAF1SMYD2L3MBTL1MEN1
SCHEMBL14430805 0.87 LMNA (0.56) LMNARAF1SMYD2L3MBTL1MEN1
SCHEMBL14430802 0.87 RAF1 (0.61) LMNARAF1SMYD2L3MBTL1MEN1
SCHEMBL5474268 0.86 MCHR1 (0.56) LMNARAF1SMYD2L3MBTL1MEN1
SCHEMBL5477335 0.86 DRD4 (0.66) SMYD2DRD2DRD4
SCHEMBL5476704 0.86 MCHR1 (0.58) LMNARAF1SMYD2L3MBTL1MEN1
SCHEMBL5485422 0.85 DRD4 (0.59) LMNARAF1SMYD2L3MBTL1MEN1

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-20070191358-A1 Novel piperidine derivative for the treatment of depression ASTRAZENECA AB (SE) 2007-08-16 US disclosed
US-20070191358-A1 Novel piperidine derivative for the treatment of depression ASTRAZENECA AB (SE) 2007-08-16 US disclosed
US-20070191358-A1 Novel piperidine derivative for the treatment of depression ASTRAZENECA AB (SE) 2007-08-16 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-20070191358-A1 Novel piperidine derivative for the treatment of depression GRIN2C, TPH2, HTR5A LMNA 3298/4885RAF1 3994/4885SMYD2 805/4885

“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.