SCHEMBL3024734

SCHEMBL3024734

O=C(Nc1ccc(Oc2cccc(F)c2)cc1)N1CC2CC1CN2C1Cc2ccccc2C1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CFTR P13569 7/20 0.45
FAAH O00519 3/20 0.43
NPY5R Q15761 2/20 0.43
PDGFRB P09619 1/20 0.39
NPSR1 Q6W5P4 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
PAX8 Q06710 1/20 0.37
HTR2A P28223 1/20 0.37
HTR2C P28335 1/20 0.37
OPRK1 P41145 1/20 0.37
HTR2B P41595 1/20 0.37
TMEM97 Q5BJF2 1/20 0.37
SIGMAR1 Q99720 1/20 0.37
LHCGR P22888 1/20 0.37
ABL1 P00519 1/20 0.37

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
SCHEMBL3022934 0.91 CFTR (0.44) CFTRFAAHNPY5RKMT2AHTR2A
SCHEMBL3022685 0.91 NPY5R (0.43) CFTRFAAHNPY5RPDGFRBKMT2A
SCHEMBL3012867 0.90 NPY5R (0.49) CFTRFAAHNPY5RMEN1KMT2A
SCHEMBL3028509 0.87 LHCGR (0.40) CFTRFAAHPDGFRBKMT2AHTR2A
SCHEMBL3022138 0.86 NPY5R (0.45) CFTRFAAHNPY5RKMT2AHTR2A
SCHEMBL3026842 0.85 FAAH (0.42) CFTRFAAHNPY5RPAX8HTR2A
SCHEMBL3023429 0.82 LHCGR (0.40) CFTRFAAHNPY5RKMT2AHTR2A
SCHEMBL3018805 0.78 NAMPT (0.53) PAX8
SCHEMBL3023606 0.77 NAMPT (0.43) CFTRFAAH
SCHEMBL3028365 0.77 HRH3 (0.44) MEN1KMT2AHTR2CHTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100204224-A1 AZACYCLIC COMPOUNDS AS INHIBITORS OF SENSORY NEURONE SPECIFIC SODIUM CHANNELS VERNALIS R & D LIMITED (GB) 2010-08-12 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-20100204224-A1 AZACYCLIC COMPOUNDS AS INHIBITORS OF SENSORY NEURONE SPECIFIC SODIUM CHANNELS SCN1B, SCN2B, SCN1A CFTR 866/4885FAAH 597/4885NPY5R 153/4885

“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.