SCHEMBL5384112

SCHEMBL5384112

FC(F)(F)c1ccnc(N2CCc3c(Cl)ncnc3C2)c1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ADRB1 P08588 1/20 0.49
TRPV1 Q8NER1 7/20 0.44
KDM4E B2RXH2 3/20 0.39
CYP2D6 P10635 1/20 0.39
TRPC5 Q9UL62 3/20 0.38
FFAR4 Q5NUL3 1/20 0.38
P2RX3 P56373 2/20 0.37
P2RX2 Q9UBL9 1/20 0.37
TRPC4 Q9UBN4 1/20 0.37
MAPT P10636 2/20 0.37
ALDH1A1 P00352 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
SCN9A Q15858 1/20 0.36

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
SCHEMBL5385024 0.82 P2RX3 (0.46) TRPV1KDM4EP2RX3P2RX2MAPT
SCHEMBL4870311 0.77 GRIN2D (0.52) KDM4ETRPC5P2RX3ALDH1A1
SCHEMBL5430634 0.77 ADRB1 (0.50) ADRB1TRPV1KDM4ECYP2D6FFAR4
SCHEMBL5393387 0.74 TRPV1 (0.56) TRPV1
SCHEMBL5393648 0.74 TRPV1 (0.64) TRPV1MAPT
SCHEMBL5389918 0.74 TRPV1 (0.59) TRPV1
SCHEMBL2853594 0.72 P2RX3 (0.53) TRPV1KDM4EP2RX3P2RX2
SCHEMBL17298846 0.70 AR (0.65)
SCHEMBL18176129 0.70 ADRB1 (0.73) ADRB1TRPV1KDM4ECYP2D6FFAR4
SCHEMBL24008459 0.69 ADRB1 (0.71) ADRB1TRPV1KDM4ECYP2D6FFAR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7312330-B2 Bicycloheteroarylamine compounds as ion channel ligands and uses thereof RENOVIS, INC. (US) 2007-12-25 US disclosed
US-7312330-B2 Bicycloheteroarylamine compounds as ion channel ligands and uses thereof RENOVIS, INC. (US) 2007-12-25 US disclosed
US-7312330-B2 Bicycloheteroarylamine compounds as ion channel ligands and uses thereof RENOVIS, INC. (US) 2007-12-25 US disclosed
WO-2006118598-A1 BICYCLOHETEROARYLAMINE COMPOUNDS AS ION CHANNEL LIGANDS AND USES THEREOF RENOVIS, INC. (US) 2006-11-09 WO disclosed
US-20050277643-A1 Bicycloheteroarylamine compounds as ion channel ligands and uses thereof EVOTEC AG (DE) 2005-12-15 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-20050277643-A1 Bicycloheteroarylamine compounds as ion channel ligands and uses thereof TRPV1, TRPV3, TRPA1 ADRB1 636/4885TRPV1 1/4885KDM4E 3991/4885

“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.