SCHEMBL8095861

SCHEMBL8095861

Cc1cc(OC2CCN(Cc3c(F)cccc3F)CC2)c2cccc(F)c2n1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 2/20 0.41
SCN5A Q14524 1/20 0.41
SCN9A Q15858 1/20 0.41
S1PR5 Q9H228 5/20 0.40
HRH3 Q9Y5N1 2/20 0.40
KDM4E B2RXH2 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
POLB P06746 1/20 0.40
TSHR P16473 1/20 0.40
ALDH1A1 P00352 1/20 0.40
SCN1A P35498 1/20 0.40
SCN8A Q9UQD0 1/20 0.40
HTR2C P28335 2/20 0.39
HTR7 P34969 2/20 0.39
HTR2B P41595 2/20 0.39
HTR3A P46098 2/20 0.39
HTR4 Q13639 2/20 0.39
ADRA1A P35348 1/20 0.39
ROCK2 O75116 1/20 0.39
CCR2 P41597 1/20 0.39

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
SCHEMBL13945390 0.90 AR (0.39) KCNH2S1PR5HRH3SCN1ASCN8A
SCHEMBL13945353 0.90 S1PR5 (0.43) S1PR5KDM4ESMN1; SMN2POLBTSHR
SCHEMBL5526683 0.89 SCN1A (0.50) KCNH2SCN5ASCN9AKDM4ESMN1; SMN2
SCHEMBL8095680 0.89 PDE4B (0.46) KCNH2SCN5ASCN9AKDM4EPOLB
SCHEMBL4246391 0.87 SCN1A (0.42) HRH3SMN1; SMN2POLBSCN1ASCN8A
SCHEMBL8104062 0.86 ACHE (0.48) SCN1ASCN8AHTR1D
SCHEMBL8100160 0.86 HTR1A (0.45) HRH3POLBSCN1ASCN8AROCK2
SCHEMBL8085163 0.86 SCN1A (0.47) KCNH2SCN5ASCN9ASMN1; SMN2SCN1A
SCHEMBL8100325 0.85 JAK2 (0.39) KCNH2SCN5ASCN9AHRH3ALDH1A1
SCHEMBL8094095 0.85 GRIN1 (0.40) KCNH2SCN5ASCN9AHRH3KDM4E

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 KCNH2 43/4885SCN5A 113/4885SCN9A 125/4885

“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.