SCHEMBL8104062

SCHEMBL8104062

Cc1cc(OC2CCN(Cc3ccc4ccccc4c3)CC2)c2cccc(F)c2n1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.48
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
MCHR1 Q99705 3/20 0.44
ENPP2 Q13822 4/20 0.44
SCN1A P35498 2/20 0.42
SCN8A Q9UQD0 2/20 0.42
SLC6A2 P23975 1/20 0.41
SLC6A4 P31645 1/20 0.41
SLC6A3 Q01959 1/20 0.41
CCR3 P51677 1/20 0.41
HTR1D P28221 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
SCHEMBL8097670 0.92 CCR3 (0.43) MEN1KMT2AMCHR1ENPP2CCR3
SCHEMBL5526683 0.90 SCN1A (0.50) MCHR1SCN1ASCN8A
SCHEMBL8100160 0.89 HTR1A (0.45) ACHEMEN1KMT2ASCN1ASCN8A
SCHEMBL8102253 0.88 HTR1A (0.47) MCHR1SCN1ASCN8AHTR1D
SCHEMBL4246391 0.87 SCN1A (0.42) ENPP2SCN1ASCN8AHTR1D
SCHEMBL8085163 0.86 SCN1A (0.47) MCHR1SCN1ASCN8A
SCHEMBL4245768 0.86 NPC1 (0.48) MEN1KMT2ASCN1ASCN8A
SCHEMBL8095680 0.86 PDE4B (0.46) ACHEMEN1KMT2ASCN1ASCN8A
SCHEMBL8095861 0.86 KCNH2 (0.41) SCN1ASCN8AHTR1D
SCHEMBL8108269 0.85 RAB9A (0.47) MEN1KMT2ASCN1ASCN8A

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-20090023773-A1 COMPOSITIONS AND METHODS FOR MODULATING GATED ION CHANNELS PAINCEPTOR PHARMA CORPORATION (CA) 2009-01-22 US disclosed
US-20090023773-A1 COMPOSITIONS AND METHODS FOR MODULATING GATED ION CHANNELS PAINCEPTOR PHARMA CORPORATION (CA) 2009-01-22 US disclosed
WO-2009000085-A1 QUINOLINE AND QUINAZOLINE DERIVATIVES USEFUL AS MODULATORS OF GATED ION CHANNELS PAINCEPTOR PHARMA CORPORATION (CA) 2008-12-31 WO 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-20090023773-A1 COMPOSITIONS AND METHODS FOR MODULATING GATED ION CHANNELS TRPV1, TRPV2, TRPA1 ACHE 274/4885MEN1 4478/4885KMT2A 3931/4885

“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.