SCHEMBL5480122

SCHEMBL5480122

O=C(NCCCN1CCCCC1)c1ccc(Oc2cccc(F)c2)cc1

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 8/20 0.58
NAMPT P43490 2/20 0.55
LMNA P02545 1/20 0.52
SCN9A Q15858 2/20 0.52
MCHR2 Q969V1 1/20 0.52
POLB P06746 1/20 0.51
MAPT P10636 1/20 0.51
RECQL P46063 1/20 0.51
RAF1 P04049 1/20 0.50
CHRM4 P08173 1/20 0.50
CACNA1G O43497 1/20 0.50
TACR2 P21452 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
SCHEMBL5476704 0.93 MCHR1 (0.58) MCHR1NAMPTLMNAPOLBMAPT
SCHEMBL18502060 0.91 L3MBTL3 (0.58) MCHR1NAMPTLMNACHRM4
SCHEMBL5483156 0.89 SCN9A (0.59) NAMPTLMNASCN9APOLBMAPT
SCHEMBL14430677 0.88 CHRM4 (0.62) MCHR1NAMPTLMNAMCHR2POLB
SCHEMBL5473741 0.87 POLB (0.63) MCHR1MCHR2POLBMAPTCACNA1G
SCHEMBL5477276 0.87 MCHR1 (0.54) MCHR1NAMPTLMNASCN9AMCHR2
SCHEMBL14430782 0.87 LTA4H (0.59) MCHR1LMNASCN9AMCHR2POLB
SCHEMBL14430802 0.85 RAF1 (0.61) MCHR1LMNASCN9AMCHR2RAF1
SCHEMBL14430779 0.84 LMNA (0.70) MCHR1LMNAMCHR2RAF1
SCHEMBL5484460 0.84 ALDH1A1 (0.53) NAMPTLMNASCN9APOLBMAPT

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 MCHR1 1280/4885NAMPT 3438/4885LMNA 3298/4885

“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.